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MassChroBook

Two-dimensional mass chromatogram images for all samples are available as Microsoft PowerPoint files.

MassChroBook (26 Jun 2018)

 

PowerGetBatch parameters

A set of parameter files for PowerGetBatch tool which was used for peak detection and alignment. The PowerGetBatch tool is available from the link page shown below.

PowerGetBatch parameter files

 

Previous data

The previous versions of the published data are available below. We archive the repository data irregularly when we overwrite the published data. This ensures the reproducibility of the data analysis performed with this repository.
Please note that we do not change the peak file set and the mass chromatogram data (.raw and .mzXML) available in the “LC-MS data” below.

manual_previousData_en.pdf（301 KB）
The user guide for use of the previous data.
archive_FoodMR_210428.zip（145 MB）
Published: 2022/04/28, Archived: 2022/04/18
archive_FoodMR_220418.zip（193 MB）
Published: 2022/04/18, Archived: 2022/04/18

 

Retention time converter

This MS Excel file provides the retention time conversion between ThingMR and FoodMR/PlantMR. This is for your information, too, when you convert the retention time between XMRs and your own LC-MS system.
Note: The results are just approximated values and are not accurate.

 

LC-MS data

The list of detected peaks, raw mass chromatogram data (ThermoFisher .raw), and the mass chromatogram data converted to mzXML format are available for each sample. The mzXML files and the peak list files can be analyzed using MassChroViewer tool which is available below.

No. Category Name Image  
Cereals Common wheat, bread, white
Cereals Common wheat, "Udon" (thick wheat noodles), uncooked
Cereals Common wheat, "Chikuwabu" (tube-shaped steamed wheat dough)
Cereals Rice, paddy rice, brown rice, raw
Cereals Rice, paddy rice, non-glutinous, well-milled, raw
Cereals Rice, short grain, paddy rice, brown, "meshi" (cooked rice)
Cereals Rice, short grain, paddy rice, nonglutinous rice, well-milled, "meshi" (cooked rice)
Cereals Buckwheat flour, straight
Cereals Corn, whole grain, yellow kernel, raw
Cereals Rice, paddy rice, glutinous rice, well-milled, raw
Cereals Rice, short grain, paddy rice, glutinous rice, well-milled, "meshi" (cooked rice)
Potatoes and starches Konjac, block, made from fine powder
Potatoes and starches Sweet potato, tuberous root, without skin, raw
Potatoes and starches Taro, "Satoimo", corm, raw
Potatoes and starches Potatoes, tuber, raw
Potatoes and starches Yam, Chinese yam, "Ichoimo", tuberous root, raw
Sugars and sweeteners Sugars, brown sugar lump
Sugars and sweeteners Sugars, "Wasanbonto" (traditional non-centrifugal soft white cane sugar)
Sugars and sweeteners Sugars, hard sugars, granulated
Sugars and sweeteners Honey
Sugars and sweeteners Maple syrup
Pulses Adzuki beans, mature seeds, whole, raw
Pulses Kidney beans, mature seeds, whole, raw
Pulses Peas, mature seeds, green seed coats and cotyledons, whole, raw
Pulses Cowpeas, mature seeds, whole, raw
Pulses Soybeans, mature seeds, whole, domestic, yellow seed coats, raw
Pulses Soybeans, mature seeds, whole, domestic, yellow seed coats, raw (Koito Zairai)
Pulses Soybeans, tofu, "Momen-tofu" (regular tofu)
Pulses Soybeans, natto, "Itohiki-natto" (fermented whole soybean)
Pulses Chickpeas*, mature seeds, whole, raw, [*Syn. Garbanzo beans]
Pulses Mung beans, mature seeds, whole, raw
Pulses Lentils, mature seeds, whole, raw
Nuts and seeds Cashew nuts, oil-roasted and salted
Nuts and seeds Pumpkin seeds, roasted and salted
Nuts and seeds Ginkgo nuts, raw
Nuts and seeds Chestnuts, Japanese chestnuts, raw
Nuts and seeds Walnuts, roasted
Nuts and seeds Sesame seeds, whole, dried and roasted (white)
Nuts and seeds Sesame seeds, whole, dried and roasted (black)
Nuts and seeds Pistachio nuts, roasted and salted
Nuts and seeds Macadamia nuts, roasted and salted
Nuts and seeds Peanuts, mature seeds, Virginia type, raw
Nuts and seeds Almonds, roasted, without salt
Vegetables Asparagus, green, shoots, raw
Vegetables Kidney beans, "Sayaingen", immature pods, raw
Vegetables Soybeans, immature*, raw, [*Syn. Green soybeans]
Vegetables Peas, stem and leaves, raw
Vegetables Okra, pods, raw
Vegetables Turnip, root, with skin, raw
Vegetables Cauliflower, inflorescence, raw
Vegetables Chrysanthemum, petals, raw (yellow)
Vegetables Chrysanthemum, petals, raw (pink)
Vegetables Cabbage, common, head, raw
Vegetables Cucumber, fruit, raw
Vegetables Leaf green, "Mizuna", leaves, raw
Vegetables Ostrich-feather fern, fiddlehead, raw
Vegetables Edible burdock, root, raw
Vegetables Spinach mustard, "Komatsuna", leaves, raw
Vegetables Sweet peppers, "Shishito", fruit, raw
Vegetables Perilla, "Shiso", leaves, raw
Vegetables Garland chrysanthemum, leaves, raw
Vegetables Ginger, mature rhizome, raw
Vegetables Water dropwort, stems and leaves, raw
Vegetables Broad beans, immature beans, raw
Vegetables Japanese radishes, Daikon, root with skin, raw
Vegetables Bamboo shoots, boiled
Vegetables Onions, bulb, raw
Vegetables Japanese angelica-tree, spears, raw
Vegetables Green bok choy, leaves, raw
Vegetables Malabar nightshade, stems and leaves, raw
Vegetables Chinese preserving melon, fruit, raw
Vegetables Corn, sweet corn, immature kernels, raw
Vegetables Tomatoes, fruit, raw
Vegetables Eggplant*, Japanese type, fruit, raw, [*Syn. Aubergine]
Vegetables Bitter melon, fruit, raw
Vegetables Chinese chive, leaves, raw
Vegetables Carrot, regular (European type), root with skin, raw
Vegetables Garlic, bulb, raw
Vegetables Welsh onions, "Nebuka-negi" (large variety, blanching cultivation), leaves, raw
Vegetables Welsh onions, "Ha-negi" (large variety, green), leaves, raw
Vegetables Japanese bunching onion (Jakkou), leaf, raw
Vegetables Parsley, leaves, raw
Vegetables Little radish, root, raw
Vegetables Sweet peppers, fruit, green, raw
Vegetables Japanese butterbur, petiole, raw
Vegetables Japanese butterbur, inflorescence, raw
Vegetables Broccoli, inflorescence, raw
Vegetables Spinach, leaves, all season, raw
Vegetables Japanese ginger, "Myoga", spike, raw
Vegetables Brussels sprouts, head, raw
Vegetables Bean sprouts, soybean sprouts, raw
Vegetables Nalta jute*, stems and leaves, raw, [*Syn. Tossa jute]
Vegetables Japanese wormwood, leaves, raw
Vegetables Peanuts, immature beans, raw
Vegetables Japanese scallion, "Rakkyo", mature bulb, raw
Vegetables Lettuce, head lettuce, crisp type, soil culture, head, raw
Vegetables Lettuce, green leaf lettuce, leaves, raw
Vegetables East Indian lotus root, rhizome, raw
Vegetables Wasabi, rhizome, raw
Vegetables Bracken fern, fiddleheads, raw
Fruits Avocados, raw
Fruits Strawberries, raw
Fruits Figs, raw
Fruits Mume*, raw, [*Syn. Japanese apricots]
Fruits Satsuma mandarins, segments, early ripening type, raw
Fruits Japanese persimmons*, nonastringent, raw, [*Syn. Kaki]
Fruits Citrus, "Kabosu", juice, fresh
Fruits Kiwifruit, green flesh type, raw
Fruits Grapefruit, white flesh type, juice sacs, raw
Fruits Sweet cherries, domestic, raw
Fruits Watermelon, red flesh type, raw
Fruits Citrus, "Sudachi", peel, raw
Fruits Citrus, "Sudachi", juice, fresh
Fruits Pears, sand pears*, raw [Syn. Nashi pears]
Fruits Pears, European pears, raw
Fruits Pineapple, raw
Fruits Bananas, raw
Fruits Papaya, ripe, raw
Fruits Loquats, raw
Fruits Grapes, raw
Fruits Blueberries, raw
Fruits Mangoes, raw
Fruits Muskmelon, greenhouse culture, raw
Fruits Peaches, raw
Fruits Citrus, "Yuzu", peel, raw
Fruits Citrus, "Yuzu", juice, fresh
Fruits Lemons, whole, raw
Fruits Kiwifruit, yellow flesh type, raw
Mushrooms Mushrooms, winter mushrooms*, raw [*Syn. Enokitake, Enoki]
Mushrooms Mushrooms, tree ears, Jew's ear, dried, raw
Mushrooms Mushrooms, beech mushrooms, raw
Mushrooms Mushrooms, "Nameko", raw
Mushrooms Mushrooms, king oyster mushrooms, raw
Mushrooms Mushrooms, "Maitake", raw
Mushrooms Mushrooms, button mushrooms, fresh, raw
Mushrooms Mushrooms, "Shiitake", bed-log cultivation, fresh, raw
Algae Algae, Sea lettuce, dried
Algae Algae, green laver, dried
Algae Algae, purple laver, dried, toasted
Algae Algae, "Wakame", blanched and salted products, desalted
Fish, mollusks and crustacean Fish, horse mackerel, Japanese Jack mackerel＊, with skin, raw [*Syn. horse mackerel]
Fish, mollusks and crustacean Fish, Ayu, cultured, raw
Fish, mollusks and crustacean Fish, three-line grunt, raw
Fish, mollusks and crustacean Fish, sardine, Japanese pilchard, raw
Fish, mollusks and crustacean Fish, swordfish, raw
Fish, mollusks and crustacean Fish, skipjack tuna*, caught in spring, raw [*Syn. bonito, skipjack]
Fish, mollusks and crustacean Fish, righteye flounder, brown sole, raw
Fish, mollusks and crustacean Fish, leatherfish*, raw [*Syn. Triggerfish, threadsail filefish]
Fish, mollusks and crustacean Fish, splendid alfonsino*, raw, [*Syn. alfonsino]
Fish, mollusks and crustacean Fish, salmon and trout, pink salmon, raw
Fish, mollusks and crustacean Fish, salmon and trout, chum salmon, raw
Fish, mollusks and crustacean Fish, salmon and trout, chum salmon, "Ikura" (raw roe)
Fish, mollusks and crustacean Fish, Pacific saury, with skin, raw
Fish, mollusks and crustacean Fish, sea bream, red sea bream, wild, raw
Fish, mollusks and crustacean Fish, Atlantic cutlassfish*, raw, [*Syn. Hairtail, cutlass fish]
Fish, mollusks and crustacean Fish, cod, walleye pollock*, raw, [*Syn. Alaska pollock]
Fish, mollusks and crustacean Fish, olive flounder*, wild, raw [*Syn. bastard halibut, Japanese flounder]
Fish, mollusks and crustacean Fish, yellowtail*, mature, raw [*Syn. five-ray yellowtail]
Fish, mollusks and crustacean Fish, red gurnard*, raw [*Syn. sea robin, gurnard, gurnet]
Fish, mollusks and crustacean Fish, tuna, bluefin tuna, lean meat, raw
Fish, mollusks and crustacean Fish, tuna, big-eye tuna, raw
Fish, mollusks and crustacean Mollusks, short-necked clam*, raw [*Syn. baby-neck clam, Manila clam, Japanese littleneck]
Fish, mollusks and crustacean Mollusks, Pacific oyster, cultured, raw
Fish, mollusks and crustacean Mollusks, Japanese corbicula clam*, raw
Fish, mollusks and crustacean Mollusks, hard clam, raw
Fish, mollusks and crustacean Mollusks, giant ezo-scallop*, raw [*Syn. common scallop, Japanese scallop]
Fish, mollusks and crustacean Crustacean, northern shrimp*, raw, [*Syn. pink shrimp]
Fish, mollusks and crustacean Crustacean, giant tiger prawn, cultured, raw
Fish, mollusks and crustacean Mollusks, Japanese common squid*, raw [*Syn. short-finned squid]
Fish, mollusks and crustacean Sea cucumber, raw
Fish, mollusks and crustacean Sea squirt*, raw, [*Syn. Ascidian]
Meat Beef, Japanese beef cattle, rib loin, lean and fat, raw
Meat Beef, imported beef, chuck roll, lean and fat, raw
Meat Pork, large type breed, picnic shoulder, lean and fat, raw
Meat Pork, ham, loin
Meat Pork, sausage, Vienna
Meat Lamb, shoulder, lean and fat, raw
Meat Chicken, culled, thigh, meat with skin, raw
Meat Beef, crossbred (Holstein×Japanese black) steer, rib loin, lean and fat, raw
Eggs Eggs, hen, whole, raw
Milk and milk products Liquid milk, raw milk, Holstein
Milk and milk products Yogurt, whole milk, unsweetened
Milk and milk products Lactic acid bacteria beverages, not pasteurized after fermentation, milk solids-nonfat e" 3.0%
Milk and milk products Cheese, cottage
Milk and milk products Cheese, Camembert
Milk and milk products Cheese, Gouda
Milk and milk products Cheese, Cheddar
Milk and milk products Cheese, Parmesan
Milk and milk products Cheese, blue
Milk and milk products Cheeses, processed
Beverages Fermented alcoholic beverage, "Sake", "Junmai-ginjo" (made with only rice, water and koji, brewed with labor-intensive steps, using highly polished rice)
Beverages Fermented alcoholic beverage, beer, pale
Beverages Fermented alcoholic beverage, beer, black
Beverages Fermented alcoholic beverage, wine, red
Beverages Distilled alcoholic beverage, whisky
Beverages Compound alcoholic beverage, "Umeshu" (plum liquor made from Japanese apricots)
Beverages Green tea, "Sencha" (common grade tea ), infusion
Beverages Green tea, "Hoji-cha" (roasted tea), infusion
Beverages Fermented tea, Oolong tea, infusion
Beverages Fermented tea, black tea, tea
Beverages Fermented tea, black tea, infusion
Beverages Coffee, infusion
Beverages Coffee, ready-to-drink coffee with milk and sugar, canned
Beverages Mugi-cha (roasted barley tea), infusion
Beverages Carbonated beverage, beer-flavored drink, alcohol free
Seasonings and spices Japanese Worcester sauce, common type
Seasonings and spices Vinegar, grain vinegar
Seasonings and spices Vinegar, rice vinegar
Seasonings and spices Vinegar, fruit vinegar, wine vinegar
Seasonings and spices Vinegar, fruit vinegar, cider vinegar
Seasonings and spices Soup stock, "Katsuo-bushi dashi" (stock of "Katsuo-bushi") (cf. 10091"Katsuo-bushi")
Seasonings and spices Soup stock, "kombu dashi" (stock of dried kombu )
Seasonings and spices Soup stock, "Katsuo-bushi and kombu dashi" (stock of "Katsuo-bushi" and dried kombu) (cf. 10091"Katsuo-bushi")
Seasonings and spices Soup stock, "Shiitake dashi" (stock of dried Shiitake mushroom)
Seasonings and spices Soup stock, "Niboshi dashi" (stock of small dried sardine)
Seasonings and spices Seasoning sauce, oyster sauce
Seasonings and spices Tomato products, ketchup
Seasonings and spices Spices, mustard, powder
Seasonings and spices Spices, pepper, black, ground
Seasonings and spices Spice, garlic, paste
Seasonings and spices Vinegar, black rice vinegar
Seasonings and spices Stock powder, chicken, pork and vegetable

 

MassChroViewer tool



 		The mzXML data and the peak list data available above can be opened by the MassChroViewer software. Detailed information, such as exact peak position, raw MSn data for each scan can be seen, and further annotation looking at the chemical structures of candidate compounds can be performed with the tool. MassChroViewer is available free of charge for academic purposes.

 

PowerGetBatch tool

PowerGetBatch tool which was used for peak detection and alignment is available here. The tool is free of charge for academic purposes.