ピーク情報
|
イネ 葉 ニッポンバレ
neg
|
| Peak #12968 MN MID: SE199_S41_M91 |
| m/z: 277.21732, RT: 81.35, 強度: 11388, ログ強度: 0.53, アダクト: [M-H]-, 共有数（同様のピークを含むサンプル数）: 4 |
| DB検索結果: (60 names) Crepenynic acid;Lamenallenic acid;9Z,11E,14Z-octadecatrienoic acid;2E,9Z,12Z-octadecatrienoic acid;Octadeca-13E-en-11-ynoic acid;7-octadec-17-en-ynoic acid;3E,9Z,12Z-octadecatrienoic acid;2-(1,2-tetra... |
| DBごとのヒット数: ALL 58 KG 5 KN 17 HM 1 LM 35 |
| 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 |
|---|---|---|---|---|
| C18H30O2 | 278.22458 | 0.070 | Crepenynate | KEGG: C07289 KNApSAcK: C00001278 LipidMAPS: LMFA01030741, LMFA01030742 |
| C18H30O2 | 278.22458 | 0.070 | Lamenallenic acid | KNApSAcK: C00047265 LipidMAPS: LMFA01030775, LMFA01030776 |
| C18H30O2 | 278.22458 | 0.070 | 9Z,11E,14Z-octadecatrienoic acid | LipidMAPS: LMFA01030773 |
| C18H30O2 | 278.22458 | 0.070 | 2E,9Z,12Z-octadecatrienoic acid | LipidMAPS: LMFA01030339 |
| C18H30O2 | 278.22458 | 0.070 | Octadeca-13E-en-11-ynoic acid | LipidMAPS: LMFA01031148 |
| C18H30O2 | 278.22458 | 0.070 | 7-octadec-17-en-ynoic acid | LipidMAPS: LMFA01031145 |
| C18H30O2 | 278.22458 | 0.070 | 3E,9Z,12Z-octadecatrienoic acid | LipidMAPS: LMFA01030140, LMFA01031055 |
| C18H30O2 | 278.22458 | 0.070 | 2-(1,2-tetra-decadienyl)-cyclopropanecarboxylic acid | LipidMAPS: LMFA01140062 |
| C18H30O2 | 278.22458 | 0.070 | 19-Hydroxy-15,16-dinor-8(17)-labden-13-one | KNApSAcK: C00023401 |
| C18H30O2 | 278.22458 | 0.070 | octaÂdec-17-en-8-ynoic acid | LipidMAPS: LMFA01031030 |
| C18H30O2 | 278.22458 | 0.070 | Hedaol A | KNApSAcK: C00045999, C00046001 |
| C18H30O2 | 278.22458 | 0.070 | 3Z,6Z,9Z-Octadecatrienoic acid | LipidMAPS: LMFA02000319 |
| C18H30O2 | 278.22458 | 0.070 | Octadec-11-en-9-ynoic acid | HMDB: HMDB0255892 LipidMAPS: LMFA01030560, LMFA01030561 |
| C18H30O2 | 278.22458 | 0.070 | 6,10,14-octadecatrienoic acid | LipidMAPS: LMFA01030142 |
| C18H30O2 | 278.22458 | 0.070 | 10Z-octadecen-8-ynoic acid | LipidMAPS: LMFA01031039 |
| C18H30O2 | 278.22458 | 0.070 | 7E-Octadecen-9-ynoic acid | LipidMAPS: LMFA01031047, LMFA01031246 |
| C18H30O2 | 278.22458 | 0.070 | 8Z,11Z,14Z-octadecatrienoic acid | LipidMAPS: LMFA02000350 |
| C18H30O2 | 278.22458 | 0.070 | 6E,9E,11E-octadecatrienoic acid | LipidMAPS: LMFA02000347, LMFA02000348 |
| C18H30O2 | 278.22458 | 0.070 | 13Z-Hexadecen-11-ynyl acetate | LipidMAPS: LMFA07010364 |
| C18H30O2 | 278.22458 | 0.070 | (E,E)-6-Methyl-10-(tetrahydro-5,5-dimethyl-2-furanyl)-5,9-undecadien-2-one | KNApSAcK: C00022148 |
| C18H30O2 | 278.22458 | 0.070 | Octadeca-5,9,12-trienoic acid | HMDB: HMDB0256562 KNApSAcK: C00053586 LipidMAPS: LMFA01030342, LMFA01030343, LMFA01030344, LMFA01030815 |
| C18H30O2 | 278.22458 | 0.070 | 7E,9Z,12Z-octadecatrienoic acid | LipidMAPS: LMFA01030345, LMFA01030346 |
| C18H30O2 | 278.22458 | 0.070 | 16-methyl-6Z,9Z,12Z-heptadecatrienoic acid | LipidMAPS: LMFA01020209 |
| C18H30O2 | 278.22458 | 0.070 | 10,12,15-octadecatrienoic acid | LipidMAPS: LMFA01030156 |
| C18H30O2 | 278.22458 | 0.070 | 9,12,14-octadecatrienoic acid | LipidMAPS: LMFA01030151 |
| C18H30O2 | 278.22458 | 0.070 | 9Z,12Z-octadecen-15R-olide | LipidMAPS: LMFA07040144 |
| C18H30O2 | 278.22458 | 0.070 | 11Z,13E,15-Hexadecatrienyl acetate | LipidMAPS: LMFA07010370 |
| C18H30O2 | 278.22458 | 0.070 | (E,E)-6,10,14-Trimethyl-5,9-pentadecadiene-2,12-dione | KNApSAcK: C00022161 |
| C18H30O2 | 278.22458 | 0.070 | 10E,12E,14E-Hexadecatrienyl acetate | LipidMAPS: LMFA07010350, LMFA07010352 |
| C18H30O2 | 278.22458 | 0.070 | (E,E)-3,7,11-Trimethyl-2,6,10-dodecatrienyl propionate | LipidMAPS: LMFA07010541 |
| C18H30O2 | 278.22458 | 0.070 | 17-octadecen-9-ynoic acid | KNApSAcK: C00047138 LipidMAPS: LMFA01030562 |
| C18H30O2 | 278.22458 | 0.070 | 4-[3-(4,8-Dimethyl-3,7-nonadienyl)-3-methyloxiranyl]-2-butanone | KNApSAcK: C00022150 |
| C18H30O2 | 278.22458 | 0.070 | Farnesylacetone epoxide | KNApSAcK: C00022164 |
| C18H30O2 | 278.22458 | 0.070 | 5Z,8Z,15Z-octadecatrienoic acid | LipidMAPS: LMFA01031363 |
| C18H30O2 | 278.22458 | 0.070 | 5beta-Estrane-3alpha,17beta-diol | KEGG: C15201 LipidMAPS: LMST02010019 |
| C18H30O2 | 278.22458 | 0.070 | 9Z,13E,15Z-octadecatrienoic acid | LipidMAPS: LMFA02000298 |
| C18H30O2 | 278.22458 | 0.070 | Gorlic acid | KNApSAcK: C00050596 LipidMAPS: LMFA01140020 |
| C18H30O2 | 278.22458 | 0.070 | (9Z,12Z,15Z)-Octadecatrienoic acid | HMDB: HMDB0001388, HMDB0030964 KEGG: C06427 KNApSAcK: C00007247 LipidMAPS: LMFA01030152, LMFA01030153, LMFA01030348, LMFA01030349, LMFA01030350, LMFA01030351, LMFA01030352, LMFA01030353 |
| C18H30O2 | 278.22458 | 0.070 | 10,12,14-octadecatrienoic acid | LipidMAPS: LMFA01030154, LMFA01030155 |
| C18H30O2 | 278.22458 | 0.070 | Punicic acid | HMDB: HMDB0030963, HMDB0248208 KEGG: C08315, C08364 KNApSAcK: C00001216, C00001236, C00029815, C00053084 LipidMAPS: LMFA01030146, LMFA01030147, LMFA01030148, LMFA01030347, LMFA01030883, LMFA01030923 |
| C18H30O2 | 278.22458 | 0.070 | (Z,E)-6,10,14-Trimethyl-5,10-pentadecadiene-2,12-dione | KNApSAcK: C00022162 |
| C18H30O2 | 278.22458 | 0.070 | 4E,6E,10Z-Hexadecatrienyl acetate | LipidMAPS: LMFA07010353, LMFA07010360 |
| C18H30O2 | 278.22458 | 0.070 | 9Z-octadecen-6-ynoic acid | LipidMAPS: LMFA01031276 |
| C18H30O2 | 278.22458 | 0.070 | 13-(2-cyclopenten-1-yl)-9Z-Tridecenoic acid | LipidMAPS: LMFA01140042 |
| C18H30O2 | 278.22458 | 0.070 | 9Z,11E,15Z-octadecatrienoic acid | LipidMAPS: LMFA02000299, LMFA02000344 |
| C18H30O2 | 278.22458 | 0.070 | Hedaol B | KNApSAcK: C00046000 |
| C18H30O2 | 278.22458 | 0.070 | Gamma-Linolenic acid | HMDB: HMDB0003073, HMDB0247113 KEGG: C06426 KNApSAcK: C00001226 LipidMAPS: LMFA01030141 |
| C18H30O2 | 278.22458 | 0.070 | Octadecatrienoic acid | HMDB: HMDB0255900 |
| C18H30O2 | 278.22458 | 0.070 | Octadec-2E-en-4-ynedioic acid | LipidMAPS: LMFA01031259 |
| C18H30O2 | 278.22458 | 0.070 | 7alpha-Hydroxy-14,15-dinor-8(17)-labden-13-one | KNApSAcK: C00023400 |
| C18H30O2 | 278.22458 | 0.070 | 5,8,11-octadecatrienoic acid | LipidMAPS: LMFA01030341, LMFA01031353 |
| C18H30O2 | 278.22458 | 0.070 | 4E,6E,11Z-Hexadecatrienyl acetate | LipidMAPS: LMFA07010354 |
| C18H30O2 | 278.22458 | 0.070 | Octa-dec-17-en-6-ynoic acid | LipidMAPS: LMFA01031029 |
| C18H30O2 | 278.22458 | 0.070 | [R-(E,E)]-13-Hydroxy-6,10,14-trimethyl-5,9,14-pentadecatrien-2-one | KNApSAcK: C00022152 |
| C18H30O2 | 278.22458 | 0.070 | 11E,13E,15Z-octadecatrienoic acid | LipidMAPS: LMFA01030777 |
| C18H30O2 | 278.22458 | 0.070 | 2alpha-Hydroxy-14,15-dinor-7-labden-13-one | KNApSAcK: C00023399 |
| C18H30O2 | 278.22458 | 0.070 | 13-(2-cyclopenten-1-yl)-4Z-tridecenoic acid | LipidMAPS: LMFA01140035 |
| C18H30O2 | 278.22458 | 0.070 | 16-heptadecen-12-ynoic acid | LipidMAPS: LMFA01031135 |
| C18H30O2 | 278.22458 | 0.070 | Calendic acid | HMDB: HMDB0030962, HMDB0246901, HMDB0304802 KNApSAcK: C00054959 LipidMAPS: LMFA01030143, LMFA01030144, LMFA01030145 |
| C18H30O2 | 278.22458 | 0.070 | (8alpha,13S)-8,13:13,17-Diepoxy-14,15-dinorlabdane | KNApSAcK: C00023379 |
MSnスペクトル情報
| Level: 2, プリカーサーm/z: 277.21744 |
| Splash: splash10-053r-0090000000-b41035207dda6e2fc60a |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 233.30 | 2327 | 44 | 1000 |
| 259.29 | 1257 | 18 | 540 |
| 257.23 | 167 | 20 | 71 |
| 261.23 | 132 | 16 | 56 |
FlavonoidSearch結果
ヒットなし
| Level: 3, プリカーサーm/z: 259.26358 |
| Splash: splash10-001v-5490000000-e159960fb83c754f1f06 |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 241.18 | 30 | 18 | 1000 |
| 97.02 | 24 | 162 | 820 |
| 231.22 | 21 | 28 | 717 |
| 148.55 | 19 | 111 | 648 |
| 239.37 | 19 | 20 | 641 |
| 80.87 | 17 | 178 | 561 |
| 83.06 | 12 | 176 | 405 |
| 189.25 | 12 | 70 | 389 |
| 255.20 | 11 | 4 | 369 |
| 163.28 | 6 | 96 | 219 |
FlavonoidSearch結果
ヒットなし