ピーク情報
|
細ネギ （若香）地下部
pos
|
| Peak #10228 MN MID: SE201_S21_M90 |
| m/z: 239.20063, RT: 100.42, 強度: 11200, ログ強度: 0.47, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 1 |
| DB検索結果: (171 names) allo-Aromadendrane-10beta,14-diol;Tricyclohumuladiol;alpha-Kessyl alcohol;linalyl pentanoate;alpha-Terpinyl pentanoate;Tremulenediol A;Senecrassidiol;[1S-[1alpha,1(R*),4a]]-1-(1,5-Dimethyl-4-hexenyl)-... |
| DBごとのヒット数: ALL 136 KG 9 KN 100 HM 12 LM 15 |
| FlavonoidSearch最大スコア MS2: 0.024, MS3: - |
DB検索結果
ppm
| 組成式 | 分子量 | 誤差(Δppm） | 候補化合物名（代表で最短名を記載） | 化合物ID |
|---|---|---|---|---|
| C15H26O2 | 238.19328 | 0.289 | allo-Aromadendrane-10beta,14-diol | KNApSAcK: C00021209 |
| C15H26O2 | 238.19328 | 0.289 | Tricyclohumuladiol | HMDB: HMDB0036730 KNApSAcK: C00022001 |
| C15H26O2 | 238.19328 | 0.289 | alpha-Kessyl alcohol | HMDB: HMDB0041589 KNApSAcK: C00020422 |
| C15H26O2 | 238.19328 | 0.289 | linalyl pentanoate | HMDB: HMDB0303896 |
| C15H26O2 | 238.19328 | 0.289 | alpha-Terpinyl pentanoate | HMDB: HMDB0032054 |
| C15H26O2 | 238.19328 | 0.289 | Tremulenediol A | KNApSAcK: C00040545 |
| C15H26O2 | 238.19328 | 0.289 | Senecrassidiol | KNApSAcK: C00021998, C00022010 |
| C15H26O2 | 238.19328 | 0.289 | Cadin-10(14)-ene-4beta,5alpha-diol | KNApSAcK: C00031641 |
| C15H26O2 | 238.19328 | 0.289 | [1S-[1alpha,1(R*),4a]]-1-(1,5-Dimethyl-4-hexenyl)-4-methyl-2-cyclohexene-1,4-diol | KNApSAcK: C00011595, C00011596 |
| C15H26O2 | 238.19328 | 0.289 | Dihydroprehelminthosporol | KNApSAcK: C00023915 |
| C15H26O2 | 238.19328 | 0.289 | Alismoxide | KNApSAcK: C00020349, C00020404, C00034524 |
| C15H26O2 | 238.19328 | 0.289 | Methyl 9-tetradecynoate | HMDB: HMDB0254572 |
| C15H26O2 | 238.19328 | 0.289 | beta-Isocyclolavandulyl isovalerate | KNApSAcK: C00035540 |
| C15H26O2 | 238.19328 | 0.289 | Dihydropseudotsugonal | KNApSAcK: C00011899 |
| C15H26O2 | 238.19328 | 0.289 | (-)-Oplodiol | KNApSAcK: C00012788 |
| C15H26O2 | 238.19328 | 0.289 | Citronellyl trans-2-methyl-2-butenoate | HMDB: HMDB0032209 LipidMAPS: LMFA07010821 |
| C15H26O2 | 238.19328 | 0.289 | 14-Thapsanol | KNApSAcK: C00021351 LipidMAPS: LMPR0103530001 |
| C15H26O2 | 238.19328 | 0.289 | (+)-Dihydrochiloscypholone | KNApSAcK: C00036302 |
| C15H26O2 | 238.19328 | 0.289 | Liguloxidol | KNApSAcK: C00020362 |
| C15H26O2 | 238.19328 | 0.289 | [1S-(1R*,4Z,6R*,11S*)]-4,7,7,11-Tetramethyl-12-oxabicyclo[9.1.0]dodec-4-en-6-ol | KNApSAcK: C00012448 |
| C15H26O2 | 238.19328 | 0.289 | LipidMAPS: LMPR01030045 |
|
| C15H26O2 | 238.19328 | 0.289 | Oxyphyllol C | KNApSAcK: C00046262 |
| C15H26O2 | 238.19328 | 0.289 | 2-(1,4,4a,5,6,7,8,8a-Octahydro-4a,8-dimethyl-2-naphthalenyl)-1,2-propanediol | KNApSAcK: C00012789 |
| C15H26O2 | 238.19328 | 0.289 | 1,5,8,8-Tetramethyl-8-bicyclo[8.1.0]undecene-2,9-diol | KNApSAcK: C00022013 |
| C15H26O2 | 238.19328 | 0.289 | Geranyl valerate | HMDB: HMDB0040281 LipidMAPS: LMFA07010617, LMFA07010899 |
| C15H26O2 | 238.19328 | 0.289 | 1beta,10betaH-Cadin-4-ene-3beta,10-diol | KNApSAcK: C00020137, C00020139 |
| C15H26O2 | 238.19328 | 0.289 | Shiromool | KNApSAcK: C00011708 |
| C15H26O2 | 238.19328 | 0.289 | Pernetol | KNApSAcK: C00020140 |
| C15H26O2 | 238.19328 | 0.289 | Flourensadiol | KNApSAcK: C00021208 |
| C15H26O2 | 238.19328 | 0.289 | Pentadecadienoic acid | HMDB: HMDB0302695 |
| C15H26O2 | 238.19328 | 0.289 | Cucumadiol | HMDB: HMDB0038136 KNApSAcK: C00020412 |
| C15H26O2 | 238.19328 | 0.289 | 3beta-Hydroxydrimenol | HMDB: HMDB0036032 KNApSAcK: C00020277 |
| C15H26O2 | 238.19328 | 0.289 | Orientalol F | KNApSAcK: C00020239, C00020240, C00037586 |
| C15H26O2 | 238.19328 | 0.289 | Geranyl 3-methylbutanoate | HMDB: HMDB0029350 LipidMAPS: LMFA07010615, LMFA07010625 |
| C15H26O2 | 238.19328 | 0.289 | Trifarienol A | KNApSAcK: C00037935, C00037936 |
| C15H26O2 | 238.19328 | 0.289 | Ferutinol | KNApSAcK: C00021385 |
| C15H26O2 | 238.19328 | 0.289 | 14-pentadecynoic acid | LipidMAPS: LMFA01030582 |
| C15H26O2 | 238.19328 | 0.289 | Dipterolone | KNApSAcK: C00021915 |
| C15H26O2 | 238.19328 | 0.289 | Rubiginosic acid | KNApSAcK: C00045049 |
| C15H26O2 | 238.19328 | 0.289 | 2-Propenyl cyclohexanehexanoate | HMDB: HMDB0037195 LipidMAPS: LMFA07010744 |
| C15H26O2 | 238.19328 | 0.289 | Patchoulan-1,12-diol | HMDB: HMDB0037284 KNApSAcK: C00021289 |
| C15H26O2 | 238.19328 | 0.289 | (Z,E)-5,7-Dodecadienyl propionate | LipidMAPS: LMFA07010538 |
| C15H26O2 | 238.19328 | 0.289 | Pleocarpenene | KNApSAcK: C00020405 |
| C15H26O2 | 238.19328 | 0.289 | Buchariol | KNApSAcK: C00038655 |
| C15H26O2 | 238.19328 | 0.289 | 12-Hydroxywiddrol | KNApSAcK: C00034367 |
| C15H26O2 | 238.19328 | 0.289 | [S-(R*,R*)]-alpha4-Methyl-alpha4-(4-methyl-3-pentenyl)-1-cyclohexene-1,4-dimethanol | KNApSAcK: C00011599 |
| C15H26O2 | 238.19328 | 0.289 | Cyperusol C | KNApSAcK: C00022006 |
| C15H26O2 | 238.19328 | 0.289 | 2,6,10-Trimethyl-3,6,11-dodecatriene-2,10-diol | HMDB: HMDB0036880 KNApSAcK: C00011426 |
| C15H26O2 | 238.19328 | 0.289 | FEMA 2646 | HMDB: HMDB0030428 KNApSAcK: C00053436 |
| C15H26O2 | 238.19328 | 0.289 | [1S-[1alpha,2beta,5beta(R*)]]-5-(1,5-Dimethyl-4-hexenyl)-2-methyl-3-cyclohexene-1,2-diol | HMDB: HMDB0031383 KNApSAcK: C00011598 |
| C15H26O2 | 238.19328 | 0.289 | 2-Methyl-6-(4-methyl-3-cyclohexen-1-yl)-6-heptene-2,3-diol | KNApSAcK: C00011597 |
| C15H26O2 | 238.19328 | 0.289 | 7Z,11Z-Tridecadienyl acetate | LipidMAPS: LMFA07010279 |
| C15H26O2 | 238.19328 | 0.289 | Kudtdiol | KNApSAcK: C00012786 |
| C15H26O2 | 238.19328 | 0.289 | Bornyl isovalerate | HMDB: HMDB0038248, HMDB0038250 KEGG: C16920 KNApSAcK: C00053132, C00053349 |
| C15H26O2 | 238.19328 | 0.289 | (1S,4Ar,5R,8S,8aS)-2,5-dimethyl-8-propan-2-yl-4,4a,6,7,8,8a-hexahydro-1H-naphthalene-1,5-diol | HMDB: HMDB0250424 |
| C15H26O2 | 238.19328 | 0.289 | 4-Hydroxydihydroagarofuran | KNApSAcK: C00013104 |
| C15H26O2 | 238.19328 | 0.289 | 4E,7Z-Tridecadienyl acetate | LipidMAPS: LMFA07010269 |
| C15H26O2 | 238.19328 | 0.289 | 2R-(Z)-Campherene-2,13-diol | KNApSAcK: C00042020, C00042098 LipidMAPS: LMPR0103800001 |
| C15H26O2 | 238.19328 | 0.289 | Aromadendrane-4beta,10beta-diol | KNApSAcK: C00021116, C00021207, C00031608, C00035096, C00052801, C00052823, C00052824 |
| C15H26O2 | 238.19328 | 0.289 | [1R-(1R*,2E,4R*,7E)]-4-Hydroxy-alpha,alpha,4,8-tetramethyl-2,7-cyclodecadiene-1-methanol | KNApSAcK: C00011712 |
| C15H26O2 | 238.19328 | 0.289 | [1S-(1R*,4S*,5E,7R*)]-4-Methyl-10-methylene-7-(1-methylethyl)-5-cyclodecene-1,4-diol | KNApSAcK: C00011701 |
| C15H26O2 | 238.19328 | 0.289 | Chrysothol | KNApSAcK: C00034973 |
| C15H26O2 | 238.19328 | 0.289 | Rhombidiol | KNApSAcK: C00031161 |
| C15H26O2 | 238.19328 | 0.289 | Angrendiol | KNApSAcK: C00011697 |
| C15H26O2 | 238.19328 | 0.289 | Isobornyl 2-methylbutyrate | HMDB: HMDB0032343 |
| C15H26O2 | 238.19328 | 0.289 | 2,10-Bisaboladiene-1,4-diol | HMDB: HMDB0037279, HMDB0302601 |
| C15H26O2 | 238.19328 | 0.289 | beta-Chenopodiol | KNApSAcK: C00012783 |
| C15H26O2 | 238.19328 | 0.289 | 2-Himachalene-7,12-diol | KNApSAcK: C00021317 |
| C15H26O2 | 238.19328 | 0.289 | Mucronatone | KNApSAcK: C00051653 |
| C15H26O2 | 238.19328 | 0.289 | Seiricardine A | KEGG: C09722 KNApSAcK: C00003185 |
| C15H26O2 | 238.19328 | 0.289 | Schisanwilsonene A | KNApSAcK: C00047557 |
| C15H26O2 | 238.19328 | 0.289 | [2R-(2alpha,4aalpha,5alpha,8abeta)]-Decahydro-5-hydroxy-a,a,4a-trimethyl-8-methylene-2-naphthalenemethanol | KNApSAcK: C00012781 |
| C15H26O2 | 238.19328 | 0.289 | 5-Hydroxy-5,6-secocaryophyllen-6-one | KNApSAcK: C00012490 |
| C15H26O2 | 238.19328 | 0.289 | 3,7,11-Trimethyl-1,5,10-dodecatriene-3,7-diol | KNApSAcK: C00011427 |
| C15H26O2 | 238.19328 | 0.289 | Methyl (Z,Z)-5,8-tetradecadienoate | HMDB: HMDB0039130 |
| C15H26O2 | 238.19328 | 0.289 | (+)-Germacrenone | HMDB: HMDB0035887 KNApSAcK: C00011733 |
| C15H26O2 | 238.19328 | 0.289 | Widdrol epoxide | KNApSAcK: C00021964 |
| C15H26O2 | 238.19328 | 0.289 | Bisabolol oxide A | HMDB: HMDB0038196 KEGG: C16773 KNApSAcK: C00011651 |
| C15H26O2 | 238.19328 | 0.289 | (+)-Pterocarpol | KNApSAcK: C00012782 |
| C15H26O2 | 238.19328 | 0.289 | Bisabolol oxide B | HMDB: HMDB0038197 KEGG: C16774 KNApSAcK: C00011652, C00034802 |
| C15H26O2 | 238.19328 | 0.289 | Guaidiol | HMDB: HMDB0033228 KNApSAcK: C00022014 |
| C15H26O2 | 238.19328 | 0.289 | Arctiol | KNApSAcK: C00012785 |
| C15H26O2 | 238.19328 | 0.289 | 3S,7,11-Trimethyl-6,10-dodecadienoic acid | LipidMAPS: LMFA01030790 |
| C15H26O2 | 238.19328 | 0.289 | CAF-603 | KNApSAcK: C00021384 |
| C15H26O2 | 238.19328 | 0.289 | (2alpha,3beta,6alpha)-6-Ethenyltetrahydro-2,6-dimethyl-2-(4-methyl-3-pentenyl)-2H-pyran-3-ol | KNApSAcK: C00011473 |
| C15H26O2 | 238.19328 | 0.289 | 10alpha,11-Dihydroxyamorph-4-ene | KNApSAcK: C00038117 |
| C15H26O2 | 238.19328 | 0.289 | Bornyl valerate | HMDB: HMDB0038247 |
| C15H26O2 | 238.19328 | 0.289 | Kanokonol | KEGG: C17427 KNApSAcK: C00017514 |
| C15H26O2 | 238.19328 | 0.289 | (E,Z)-2,4-Decadienyl isovalerate | KNApSAcK: C00035994 |
| C15H26O2 | 238.19328 | 0.289 | Geranyl isovalerate | HMDB: HMDB0032291 KNApSAcK: C00030376 LipidMAPS: LMFA07010894 |
| C15H26O2 | 238.19328 | 0.289 | 4-Cadinene-10,14-diol | KNApSAcK: C00020184 |
| C15H26O2 | 238.19328 | 0.289 | Isocalamendiol | HMDB: HMDB0034673 KNApSAcK: C00020064 |
| C15H26O2 | 238.19328 | 0.289 | Ilicic alcohol | KNApSAcK: C00012792 |
| C15H26O2 | 238.19328 | 0.289 | Debneyol | KEGG: C09653 KNApSAcK: C00003125 |
| C15H26O2 | 238.19328 | 0.289 | Clausantalene | KNApSAcK: C00021858 |
| C15H26O2 | 238.19328 | 0.289 | Clovane-2beta,9alpha-diol | KNApSAcK: C00021776 LipidMAPS: LMPR0103710001 |
| C15H26O2 | 238.19328 | 0.289 | alpha-Bisabolol oxide C | HMDB: HMDB0038138 KNApSAcK: C00011653 |
| C15H26O2 | 238.19328 | 0.289 | (2E,6E,9xi)-Farnesol | HMDB: HMDB0039745 |
| C15H26O2 | 238.19328 | 0.289 | alpha-Corymbolol | KNApSAcK: C00012790 |
| C15H26O2 | 238.19328 | 0.289 | alpha-Chenopodiol | KNApSAcK: C00012777 |
| C15H26O2 | 238.19328 | 0.289 | 15-Hydroxyallocedrol | KNApSAcK: C00034371 |
| C15H26O2 | 238.19328 | 0.289 | 5E,9Z-Tridecadienyl acetate | LipidMAPS: LMFA07010270, LMFA07010277, LMFA07010278 |
| C15H26O2 | 238.19328 | 0.289 | 3,7,11-Trimethyl-1,6,10-dodecatriene-3,5-diol | KNApSAcK: C00011428 |
| C15H26O2 | 238.19328 | 0.289 | 3-pentadecynoic acid | LipidMAPS: LMFA01030581 |
| C15H26O2 | 238.19328 | 0.289 | Terpenyl isovalerate | HMDB: HMDB0040273 |
| C15H26O2 | 238.19328 | 0.289 | Poitediol | KNApSAcK: C00021778 |
| C15H26O2 | 238.19328 | 0.289 | Khusinodiol | KNApSAcK: C00031907, C00031954 |
| C15H26O2 | 238.19328 | 0.289 | (E,E)-8,10-Tetradecadienyl formate | LipidMAPS: LMFA07010554 |
| C15H26O2 | 238.19328 | 0.289 | Isobaimuxinol | KNApSAcK: C00050875 |
| C15H26O2 | 238.19328 | 0.289 | Hanamyol | KNApSAcK: C00020414 |
| C15H26O2 | 238.19328 | 0.289 | (Z)-3-Nonenyl (E)-2-hexenoate | LipidMAPS: LMFA07010631 |
| C15H26O2 | 238.19328 | 0.289 | beta-Kessyl alcohol | HMDB: HMDB0031384 |
| C15H26O2 | 238.19328 | 0.289 | Isocentdarol | KNApSAcK: C00021315 |
| C15H26O2 | 238.19328 | 0.289 | 8alpha,11-Elemadiol | KNApSAcK: C00012000 |
| C15H26O2 | 238.19328 | 0.289 | (Z)-1beta-hydroxy-2-hydrolanceol | KNApSAcK: C00042019 |
| C15H26O2 | 238.19328 | 0.289 | Methyl (E)-2,6,10-trimethyl-5,9-undecadienoate | LipidMAPS: LMFA07010526 |
| C15H26O2 | 238.19328 | 0.289 | (-)-Tovarol | KNApSAcK: C00011696 |
| C15H26O2 | 238.19328 | 0.289 | Chokol B | KNApSAcK: C00011520 |
| C15H26O2 | 238.19328 | 0.289 | Omphadiol | KNApSAcK: C00046841 |
| C15H26O2 | 238.19328 | 0.289 | Artabotrol | KNApSAcK: C00050331 |
| C15H26O2 | 238.19328 | 0.289 | 3beta-Hydroxyliguloxide | KNApSAcK: C00020364 |
| C15H26O2 | 238.19328 | 0.289 | Verticillatol | KNApSAcK: C00037985 |
| C15H26O2 | 238.19328 | 0.289 | alpha-Guaiol | KNApSAcK: C00029669 |
| C15H26O2 | 238.19328 | 0.289 | Teucladiol | KNApSAcK: C00043973 |
| C15H26O2 | 238.19328 | 0.289 | 3-Hydroxypseudowiddran-6(7)-en-4-ol | KNApSAcK: C00034391 |
| C15H26O2 | 238.19328 | 0.289 | Culmorin | KNApSAcK: C00021971 |
| C15H26O2 | 238.19328 | 0.289 | 4,11,11-Trimethyltricyclo[6.3.1.02.5]dodecane-6,8-diol | KNApSAcK: C00022016 |
| C15H26O2 | 238.19328 | 0.289 | (Z,E)-2,6,10-trimethyl-2,6,11-Dodecatriene-1,10-diol | KNApSAcK: C00011423, C00011424 |
| C15H26O2 | 238.19328 | 0.289 | Daucol | HMDB: HMDB0035287 KEGG: C09652 KNApSAcK: C00003124 |
| C15H26O2 | 238.19328 | 0.289 | Chaenocephalol | KNApSAcK: C00012778, C00012780, C00038725, C00044484, C00048826 |
| C15H26O2 | 238.19328 | 0.289 | Chokol C | KNApSAcK: C00011521, C00011522 |
| C15H26O2 | 238.19328 | 0.289 | Ptilostemonol | KNApSAcK: C00011649 |
| C15H26O2 | 238.19328 | 0.289 | (-)-Puliglene | KNApSAcK: C00011699 |
| C15H26O2 | 238.19328 | 0.289 | Centarol | KEGG: C09632 KNApSAcK: C00003113 |
| C15H26O2 | 238.19328 | 0.289 | Lubiminol | KNApSAcK: C00043348, C00043675 |
MSnスペクトル情報
| Level: 2, プリカーサーm/z: 239.20053 |
| Splash: splash10-059t-8900000000-d815c4cec28117b5d0e0 |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 95.04 | 31005 | 144 | 1000 |
| 109.03 | 28431 | 130 | 916 |
| 81.00 | 18182 | 158 | 586 |
| 84.98 | 15818 | 154 | 510 |
| 122.99 | 14831 | 116 | 478 |
| 163.15 | 9259 | 76 | 298 |
| 137.09 | 6534 | 102 | 210 |
| 113.03 | 6053 | 126 | 195 |
| 221.25 | 5352 | 18 | 172 |
| 147.08 | 4920 | 92 | 158 |
| 96.95 | 4775 | 142 | 153 |
| 120.97 | 4725 | 118 | 152 |
| 203.23 | 4536 | 36 | 146 |
| 78.92 | 4467 | 160 | 144 |
| 193.26 | 4454 | 46 | 143 |
| 151.10 | 4401 | 88 | 141 |
| 82.98 | 4207 | 156 | 135 |
| 107.02 | 4090 | 132 | 131 |
| 135.02 | 3786 | 104 | 122 |
| 98.99 | 3771 | 140 | 121 |
FlavonoidSearch結果
| Score | Symbolized Name | MSMS-Category | MSMS-Aglycone |
|---|---|---|---|
| 0.071 | [Flavone]-A(1OH)-B(none) | Flavone | Primuletin |
| 0.034 | [Flavone]-A(none)-B(1OH) | Flavone | 2'-Hydroxyflavone |
| 0.034 | [Chalcone]-A(1OMe)-B(none) | Chalcone | 4'-Methoxychalcone |
| 0.000 | [Aurone]-A(none)-B(1OH) | Aurone | 2'-Hydroxyaurone |
| Level: 3, プリカーサーm/z: 108.96413 |
| Splash: splash10-014i-9000000000-454fa2b92b7273b7829b |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 67.04 | 508 | 42 | 1000 |
| 81.13 | 106 | 28 | 209 |
FlavonoidSearch結果
ヒットなし