ピーク情報
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リーフレタスグリーン
pos
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| Peak #3938 MN MID: SE198_S12_M90 |
| m/z: 279.12287, RT: 35.90, 強度: 11196, ログ強度: 0.55, 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: (65 names) Conchosin A;2beta,9xi-Dihydroxy-8-oxo-1(10),4,11(13)-germacratrien-12,6alpha-olide;Populene G;(+)-Populene G;Antheindurolide B;Menverin F;(+)-Menverin F;Bisseccotanapartholide;Villosin A;11beta,13-Dih... |
| DBごとのヒット数: ALL 54 KG 6 KN 43 HM 4 LM 1 |
| FlavonoidSearch最大スコア MS2: -, MS3: - |
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安定同位体ラベル実験で見積もられた原子数:
N: 0
S: 0
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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 |
|---|---|---|---|---|
| C15H18O5 | 278.11542 | 0.616 | Conchosin A | KEGG: C09363 KNApSAcK: C00003233 |
| C15H18O5 | 278.11542 | 0.616 | 2beta,9xi-Dihydroxy-8-oxo-1(10),4,11(13)-germacratrien-12,6alpha-olide | HMDB: HMDB0036662 |
| C15H18O5 | 278.11542 | 0.616 | Populene G | KNApSAcK: C00040056, C00040057 |
| C15H18O5 | 278.11542 | 0.616 | Antheindurolide B | KNApSAcK: C00012409 |
| C15H18O5 | 278.11542 | 0.616 | Menverin F | KNApSAcK: C00048772 |
| C15H18O5 | 278.11542 | 0.616 | Bisseccotanapartholide | KNApSAcK: C00020986 |
| C15H18O5 | 278.11542 | 0.616 | Villosin A | KNApSAcK: C00021121 |
| C15H18O5 | 278.11542 | 0.616 | Paniculide C | KNApSAcK: C00011909 |
| C15H18O5 | 278.11542 | 0.616 | 11beta,13-Dihydrolactucin | KNApSAcK: C00020578, C00029376 |
| C15H18O5 | 278.11542 | 0.616 | Hieracin II | KNApSAcK: C00020580 |
| C15H18O5 | 278.11542 | 0.616 | Marasmone | HMDB: HMDB0036049 KNApSAcK: C00020316 |
| C15H18O5 | 278.11542 | 0.616 | Artelin | KNApSAcK: C00020551 |
| C15H18O5 | 278.11542 | 0.616 | Tanaphillin | KNApSAcK: C00021056 |
| C15H18O5 | 278.11542 | 0.616 | Radulifolin A | KNApSAcK: C00045896, C00046346 |
| C15H18O5 | 278.11542 | 0.616 | 1,10:2,3-Diepoxy-4-hydroxy-11(13)-guaien-12,6-olide | KNApSAcK: C00054226 |
| C15H18O5 | 278.11542 | 0.616 | Pulvilloric acid | KNApSAcK: C00053719 |
| C15H18O5 | 278.11542 | 0.616 | Pentalenolactone F | KEGG: C20397 KNApSAcK: C00018486 |
| C15H18O5 | 278.11542 | 0.616 | epi-Antheindurolide B | KNApSAcK: C00033818 |
| C15H18O5 | 278.11542 | 0.616 | Zinnolide | KEGG: C09983 KNApSAcK: C00003026 |
| C15H18O5 | 278.11542 | 0.616 | Solanolone | HMDB: HMDB0033262 |
| C15H18O5 | 278.11542 | 0.616 | Charminarone | KNApSAcK: C00036895 |
| C15H18O5 | 278.11542 | 0.616 | Eleganolactone B | KNApSAcK: C00044742 |
| C15H18O5 | 278.11542 | 0.616 | (-)-Etharvensin | KNApSAcK: C00036275 |
| C15H18O5 | 278.11542 | 0.616 | Secotanapartholide B | KNApSAcK: C00031344, C00048117 |
| C15H18O5 | 278.11542 | 0.616 | Dysodensiol A | KNApSAcK: C00033792, C00033793 |
| C15H18O5 | 278.11542 | 0.616 | Achimilic acid | HMDB: HMDB0037325 KNApSAcK: C00054662, C00055385, C00055386, C00055387 |
| C15H18O5 | 278.11542 | 0.616 | Merrillin | KNApSAcK: C00019945 |
| C15H18O5 | 278.11542 | 0.616 | 8beta-Hydroxyeremophil-7(11)-ene-6alpha,15 | KNApSAcK: C00017399 |
| C15H18O5 | 278.11542 | 0.616 | Grandilobalide C | KNApSAcK: C00044188 |
| C15H18O5 | 278.11542 | 0.616 | Illudoic acid | KNApSAcK: C00021489 |
| C15H18O5 | 278.11542 | 0.616 | Raxofelast | HMDB: HMDB0257115 |
| C15H18O5 | 278.11542 | 0.616 | [9S-(9R*,10E,11aS*)]- 5,6,9,11a-Tetrahydro-9-hydroxy-3-(hydroxymethyl)-10-methyl-6-methylenecyclodeca[b]furan-2,7(4H,8H)-dione | KNApSAcK: C00012251 |
| C15H18O5 | 278.11542 | 0.616 | Ulopterol | KNApSAcK: C00037970 |
| C15H18O5 | 278.11542 | 0.616 | Iso-seco-tana-partholide | KNApSAcK: C00021041 |
| C15H18O5 | 278.11542 | 0.616 | Hyporadiolide | KNApSAcK: C00020562 |
| C15H18O5 | 278.11542 | 0.616 | (+)-Meranzin hydrate | HMDB: HMDB0254461 KNApSAcK: C00029304, C00037493 |
| C15H18O5 | 278.11542 | 0.616 | Avicennone G | KNApSAcK: C00038547 |
| C15H18O5 | 278.11542 | 0.616 | (+)-Etharvendiol | KNApSAcK: C00036306 |
| C15H18O5 | 278.11542 | 0.616 | 3,4-Dihydrolactucin | KNApSAcK: C00054156 |
| C15H18O5 | 278.11542 | 0.616 | Urospermal A | KNApSAcK: C00034333 |
| C15H18O5 | 278.11542 | 0.616 | Panal | KNApSAcK: C00020110 |
| C15H18O5 | 278.11542 | 0.616 | Isohelenol | KEGG: C09485 KNApSAcK: C00003307 |
| C15H18O5 | 278.11542 | 0.616 | Daldinin A | KNApSAcK: C00052889 |
| C15H18O5 | 278.11542 | 0.616 | Dictamdiol | KNApSAcK: C00030125, C00030522, C00039015, C00039016 |
| C15H18O5 | 278.11542 | 0.616 | Leptonol | KNApSAcK: C00044213 |
| C15H18O5 | 278.11542 | 0.616 | Acronyculatin A | KNApSAcK: C00044496 |
| C15H18O5 | 278.11542 | 0.616 | Tanaparthin beta-peroxide | KNApSAcK: C00020584, C00020586 |
| C15H18O5 | 278.11542 | 0.616 | LipidMAPS: LMPR0103090029 |
|
| C15H18O5 | 278.11542 | 0.616 | Isomarasmone | HMDB: HMDB0036052 KNApSAcK: C00020319 |
| C15H18O5 | 278.11542 | 0.616 | (+)-Juricanolide | KNApSAcK: C00011745 |
| C15H18O5 | 278.11542 | 0.616 | Artecanin | HMDB: HMDB0249584, HMDB0302700 KEGG: C09302, C09354 KNApSAcK: C00000238, C00000239, C00020463 |
| C15H18O5 | 278.11542 | 0.616 | 11-Hydroxy-12-methoxydihydrokavain | HMDB: HMDB0030766 KNApSAcK: C00029378 |
| C15H18O5 | 278.11542 | 0.616 | Coriamyrtin | KEGG: C09379 KNApSAcK: C00003238 |
| C16H14ON4 | 278.11676 | -4.193 | Adibendan | HMDB: HMDB0248011 |
MSnスペクトル情報
| Level: 2, プリカーサーm/z: 279.12277 |
| Splash: splash10-014i-0290000000-b6a2048d9b9601df4550 |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 215.05 | 10358 | 64 | 1000 |
| 261.12 | 5100 | 18 | 492 |
| 187.04 | 2464 | 92 | 237 |
| 243.11 | 1952 | 36 | 188 |
| 233.12 | 1508 | 46 | 145 |
| 159.00 | 922 | 120 | 89 |
| 177.08 | 715 | 102 | 68 |
| 197.11 | 667 | 82 | 64 |
| 169.06 | 622 | 110 | 60 |
FlavonoidSearch結果
| Score | Symbolized Name | MSMS-Category | MSMS-Aglycone |
|---|---|---|---|
| 0.000 | [Aurone]-A(1OH, 1([2,3:@@]-Furano))-B(none) | Aurone | 4-Hydroxyfurano[2'',3'':6,7]aurone |
| 0.000 | [Chalcone]-A(1OMe, 1([2,3:@@]-Furano))-B(none) | Chalcone | Ovalitenin A |
| 0.000 | [Flavone]-A(1([2,3:@@]-Furano))-B(1OH) | Flavone | 3'-Hydroxy-[2'',3'':7,8]furanoflavone |
| 0.000 | [Flavone]-A(1OH, 1([2,3:@@]-Furano))-B(none) | Flavone | 6-Hydroxyfurano[2'',3'':7,8]flavone |
| 0.000 | [Flavone]-A(1OH, 1([2,3:@@]-Furano))-B(none) | Flavone | Pongaglabol |
| 0.000 | [Pterocarpene]-A(1([2,3:@@]-Furano))-B(1OH) | Pterocarpene | Neorauteen |