ピーク情報
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ブルーベリー 生
pos
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| Peak #1828 MN MID: SE118_S071241_M90 |
| m/z: 281.13819, RT: 25.95, 強度: 1800, ログ強度: -0.12, 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: (93 names) Akihalin;Villosin B;(+)-6,7-epoxy-5-hydroxy-4(15)-hirusten-12-oic acid;Deepoxy-deoxynivalenol;(-)-Mniopetal F;Mniopetal F;Illioliganone B;(-)-Illioliganone B;1,10-Epoxy-3,8-dihydroxy-4,11(13)-germacra... |
| DBごとのヒット数: ALL 71 KG 4 KN 60 HM 4 LM 3 |
| FlavonoidSearch最大スコア MS2: -, 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 |
|---|---|---|---|---|
| C15H20O5 | 280.13107 | -0.571 | Villosin B | KNApSAcK: C00021179 |
| C15H20O5 | 280.13107 | -0.571 | Akihalin | KNApSAcK: C00020954 |
| C15H20O5 | 280.13107 | -0.571 | (+)-6,7-epoxy-5-hydroxy-4(15)-hirusten-12-oic acid | LipidMAPS: LMPR0103730002 |
| C15H20O5 | 280.13107 | -0.571 | Deepoxy-deoxynivalenol | HMDB: HMDB0250929 |
| C15H20O5 | 280.13107 | -0.571 | (-)-Mniopetal F | KNApSAcK: C00016644 |
| C15H20O5 | 280.13107 | -0.571 | Illioliganone B | KNApSAcK: C00047458 |
| C15H20O5 | 280.13107 | -0.571 | 1,10-Epoxy-3,8-dihydroxy-4,11(13)-germacradien-12,6-olide | HMDB: HMDB0303776 |
| C15H20O5 | 280.13107 | -0.571 | [3S-(3alpha,3aalpha,5abeta,9alpha,9aalpha,9bbeta)]-3a,5,5a,9,9a,9b-Hexahydro-9-hydroperoxy-3,5a,9-trimethylnaphtho[1,2-b]furan-2,6(3H,4H)-dione | KNApSAcK: C00013071 |
| C15H20O5 | 280.13107 | -0.571 | Jamesonin | KNApSAcK: C00021506 |
| C15H20O5 | 280.13107 | -0.571 | Canambrin | HMDB: HMDB0302335 KNApSAcK: C00020987, C00021194, C00021196 |
| C15H20O5 | 280.13107 | -0.571 | Carolenalone | KNApSAcK: C00020956 |
| C15H20O5 | 280.13107 | -0.571 | (+)-Almuheptolide B | KNApSAcK: C00036297 |
| C15H20O5 | 280.13107 | -0.571 | (11R)-11,13-Dihydroschkuhriolide | KNApSAcK: C00049912, C00049913 |
| C15H20O5 | 280.13107 | -0.571 | Anobin | KNApSAcK: C00020600 |
| C15H20O5 | 280.13107 | -0.571 | Jalaric A acid | KNApSAcK: C00021741 |
| C15H20O5 | 280.13107 | -0.571 | 5alpha-Hydroperoxyasperilin | KNApSAcK: C00022679 |
| C15H20O5 | 280.13107 | -0.571 | 7-carboxyl-6,8-dihydroxy-1,1,3,4,5-pentamethylisochroman | KNApSAcK: C00052763 |
| C15H20O5 | 280.13107 | -0.571 | Phaseic acid | HMDB: HMDB0302844 KEGG: C09707 KNApSAcK: C00003170, C00038084 |
| C15H20O5 | 280.13107 | -0.571 | (1beta,4alpha,5alpha,6beta,8alpha,10b)-1,10:4,5-Diepoxy-6-hydroxy-7(11)-germacren-12,8-olide | HMDB: HMDB0038545 |
| C15H20O5 | 280.13107 | -0.571 | Artabsinolide A | HMDB: HMDB0035620 KNApSAcK: C00020870, C00020872 |
| C15H20O5 | 280.13107 | -0.571 | Autumnolide | KEGG: C09346 KNApSAcK: C00003223, C00021099 |
| C15H20O5 | 280.13107 | -0.571 | Linderagalactone E | KNApSAcK: C00047974 |
| C15H20O5 | 280.13107 | -0.571 | Cuminiresinol | KNApSAcK: C00054970 |
| C15H20O5 | 280.13107 | -0.571 | 8-Deoxy-11,13-dihydroxygrosheimin | HMDB: HMDB0041144 KNApSAcK: C00055188 |
| C15H20O5 | 280.13107 | -0.571 | Ethyl 3-O-acetylniduloate | KNApSAcK: C00042500 |
| C15H20O5 | 280.13107 | -0.571 | 8'-Hydroxyabscisate | HMDB: HMDB0036095, [-1]HMDB0304246 KEGG: C15514 KNApSAcK: C00011541 LipidMAPS: LMPR0103050010 |
| C15H20O5 | 280.13107 | -0.571 | Artemisitene | KNApSAcK: C00020196 |
| C15H20O5 | 280.13107 | -0.571 | Varitriol | KNApSAcK: C00045431 |
| C15H20O5 | 280.13107 | -0.571 | 10alpha-Hydroxyisopsilostachyin C | KNApSAcK: C00021199 |
| C15H20O5 | 280.13107 | -0.571 | 4alpha,5alpha-Epoxy-8alpha,13-dihydroxy-1(10)E,7(11)-germacratrien-12,6alpha-olide | KNApSAcK: C00011810 |
| C15H20O5 | 280.13107 | -0.571 | epi-ANtheindurolide A-5,6-oxide | KNApSAcK: C00033817 |
| C15H20O5 | 280.13107 | -0.571 | [3aR-(3aalpha,4aalpha,5alpha,8beta,9abeta)]-3a,4,4a,5,6,8,9,9a-Octahydro-8-hydroperoxy-5-hydroxy-5,8-dimethyl-3-methylene-azuleno[6,5-b]furan-2(3H)-one | KNApSAcK: C00020915 |
| C15H20O5 | 280.13107 | -0.571 | [3aS-(3aalpha,5alpha,6alpha,6aalpha,9alpha,9aalpha,9bbeta)]-3a,4,5,6,6a,9,9a,9b-Octahydro-5,6,9-trihydroxy-6,9-dimethyl-3-methylene-azuleno[4,5-b]furan-2(3H)-one | KNApSAcK: C00020856 |
| C15H20O5 | 280.13107 | -0.571 | Penifulvin D | KNApSAcK: C00041735 |
| C15H20O5 | 280.13107 | -0.571 | Hymenoflorin | KEGG: C09480 KNApSAcK: C00003302 |
| C15H20O5 | 280.13107 | -0.571 | Epilaccishellolic acid | KNApSAcK: C00021740 |
| C15H20O5 | 280.13107 | -0.571 | Tanargyrolide | KNApSAcK: C00012394 |
| C15H20O5 | 280.13107 | -0.571 | (-)-Coriolin | KNApSAcK: C00018765 |
| C15H20O5 | 280.13107 | -0.571 | Vulgarolide | HMDB: HMDB0041003 |
| C15H20O5 | 280.13107 | -0.571 | Dihydromarasmone | HMDB: HMDB0036051 KNApSAcK: C00020318 |
| C15H20O5 | 280.13107 | -0.571 | Penifulvin B | KNApSAcK: C00041733, C00041734 |
| C15H20O5 | 280.13107 | -0.571 | Hysterone A | KNApSAcK: C00036124 |
| C15H20O5 | 280.13107 | -0.571 | Sibthorpin | KNApSAcK: C00020852, C00020853 |
| C15H20O5 | 280.13107 | -0.571 | Sanchillin | KNApSAcK: C00020848 |
| C15H20O5 | 280.13107 | -0.571 | 5-Hydroperoxy-6,13-dehydro-5,6-dihydroanthecotuloide | KNApSAcK: C00033570 |
| C15H20O5 | 280.13107 | -0.571 | LipidMAPS: LMPR0103540002 |
|
| C15H20O5 | 280.13107 | -0.571 | Peneciraistin A | KNApSAcK: C00053643, C00053644 |
| C15H20O5 | 280.13107 | -0.571 | Penifulvin E | KNApSAcK: C00041736 |
| C15H20O5 | 280.13107 | -0.571 | Tabarin | KNApSAcK: C00013022 |
| C15H20O5 | 280.13107 | -0.571 | Varioxirane | KNApSAcK: C00045430 |
| C15H20O5 | 280.13107 | -0.571 | epi-6-Hydroxy-5,6-dihydro-4,5-dehydro-antheindurolide A | KNApSAcK: C00033815 |
| C15H20O5 | 280.13107 | -0.571 | Peroxyparthenolide | KNApSAcK: C00012096 |
| C15H20O5 | 280.13107 | -0.571 | Altamisic acid | KNApSAcK: C00021181 |
| C15H20O5 | 280.13107 | -0.571 | LipidMAPS: LMPR0103540021 |
|
| C15H20O5 | 280.13107 | -0.571 | Nigellic acid | HMDB: HMDB0036094 KNApSAcK: C00011540 LipidMAPS: LMPR0103050014 |
| C15H20O5 | 280.13107 | -0.571 | 14-Hydroxy-5alpha-hydroperoxy-isoalantolactone | KNApSAcK: C00022676 |
| C15H20O5 | 280.13107 | -0.571 | [3aS-(3aalpha,5alpha,6alpha,6aalpha,8alpha,9bbeta)]-3a,4,5,6,6a,7,8,9b-Octahydro-5,6,8-trihydroxy-6,9-dimethyl-3-methylene-azuleno[4,5-b]furan-2(3H)-one | KNApSAcK: C00020851 |
| C15H20O5 | 280.13107 | -0.571 | Phaseolinone | KNApSAcK: C00017296 |
| C15H20O5 | 280.13107 | -0.571 | Epoxyflabellin | KNApSAcK: C00049867 |
| C15H20O5 | 280.13107 | -0.571 | Loukacinol A | KNApSAcK: C00046801 |
| C15H20O5 | 280.13107 | -0.571 | Creolophin B | KNApSAcK: C00055081 |
| C15H20O5 | 280.13107 | -0.571 | Dimerostemmolide | KNApSAcK: C00013024 |
| C15H20O5 | 280.13107 | -0.571 | 11beta,13-Dihydroarctiolide | KNApSAcK: C00020889 |
| C15H20O5 | 280.13107 | -0.571 | Crispolide | HMDB: HMDB0036695 KNApSAcK: C00012420 |
| C15H20O5 | 280.13107 | -0.571 | Lingshuiperoxide | KNApSAcK: C00039626 |
| C15H20O5 | 280.13107 | -0.571 | Paniculide B | KNApSAcK: C00011908 |
| C15H20O5 | 280.13107 | -0.571 | (+)-Heptelidic acid | KNApSAcK: C00016049 |
| C15H20O5 | 280.13107 | -0.571 | Hieracin I | KNApSAcK: C00020579 |
| C15H20O5 | 280.13107 | -0.571 | Zedoalactone B | KNApSAcK: C00032546 |
| C15H20O5 | 280.13107 | -0.571 | Illioliganone C | KNApSAcK: C00047459 |
| C15H20O5 | 280.13107 | -0.571 | Linderagalactone B | KNApSAcK: C00047971 |
MSnスペクトル情報
| Level: 2, プリカーサーm/z: 281.13757 |
| Splash: splash10-0udi-0090000000-b41314ee633ec1636f82 |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 251.19 | 2602 | 30 | 1000 |
| 200.02 | 1022 | 81 | 392 |
| 263.09 | 985 | 18 | 378 |
| 235.04 | 535 | 46 | 205 |
| 190.99 | 246 | 90 | 94 |
| 272.11 | 149 | 9 | 57 |
FlavonoidSearch結果
| Score | Symbolized Name | MSMS-Category | MSMS-Aglycone |
|---|---|---|---|
| 0.000 | [Pterocarpan]-A(1([2,3:@@]-Furano))-B(1OH) | Pterocarpan | Neodunol |
| Level: 3, プリカーサーm/z: 251.18695 |
| Splash: splash10-0a4i-0290000000-5949b4a70c3f43181e2c |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 209.15 | 1346 | 42 | 1000 |
| 193.11 | 308 | 58 | 228 |
| 233.01 | 161 | 18 | 119 |
| 191.08 | 104 | 60 | 76 |
| 175.05 | 83 | 76 | 61 |
FlavonoidSearch結果
ヒットなし