ピーク情報
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（その他） はちみつ
pos
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| Peak #4175 MN MID: SE112_S030221_M90 |
| m/z: 289.23720, RT: 72.69, 強度: 2127, ログ強度: -0.07, 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: (14 names) 4,12-dihydroxy-hexadecanoic acid;MG(0:0/a-13:0/0:0)[rac];9,10-dihydroxy-hexadecanoic acid;3,16-dihydroxyhexadecanoic acid;15,16-dihydroxy-hexadecanoic acid;Ethyl seco-plakortide Z;(-)-Ethyl secoplakor... |
| DBごとのヒット数: ALL 13 KG 1 KN 1 HM 5 LM 6 |
| FlavonoidSearch最大スコア MS2: 0.167, MS3: 0.136 |
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 |
|---|---|---|---|---|
| C16H32O4 | 288.23006 | -0.479 | 4,12-dihydroxy-hexadecanoic acid | LipidMAPS: LMFA01050189 |
| C16H32O4 | 288.23006 | -0.479 | MG(0:0/a-13:0/0:0)[rac] | HMDB: HMDB0072843 |
| C16H32O4 | 288.23006 | -0.479 | 9,10-dihydroxy-hexadecanoic acid | LipidMAPS: LMFA01050191 |
| C16H32O4 | 288.23006 | -0.479 | 3,16-dihydroxyhexadecanoic acid | LipidMAPS: LMFA01050487 |
| C16H32O4 | 288.23006 | -0.479 | 15,16-dihydroxy-hexadecanoic acid | LipidMAPS: LMFA01050084 |
| C16H32O4 | 288.23006 | -0.479 | Ethyl seco-plakortide Z | KNApSAcK: C00049900, C00049904 |
| C16H32O4 | 288.23006 | -0.479 | MG(0:0/13:0/0:0) | HMDB: HMDB0072861 |
| C16H32O4 | 288.23006 | -0.479 | MG(0:0/i-13:0/0:0) | HMDB: HMDB0072870 |
| C16H32O4 | 288.23006 | -0.479 | 10,16-Dihydroxyhexadecanoic acid | HMDB: HMDB0037798 KEGG: C08285 KNApSAcK: C00007440 LipidMAPS: LMFA01050341 |
| C16H32O4 | 288.23006 | -0.479 | MG(a-13:0/0:0/0:0)[rac] | HMDB: HMDB0072841 |
| C16H32O4 | 288.23006 | -0.479 | MG(13:0/0:0/0:0) | HMDB: HMDB0072845 |
| C16H32O4 | 288.23006 | -0.479 | 3,12-dihydroxy-hexadecanoic acid | LipidMAPS: LMFA01050083 |
| C16H32O4 | 288.23006 | -0.479 | 9,16-dihydroxy-hexadecanoic acid | LipidMAPS: LMFA01050340 |
MSnスペクトル情報
| Level: 2, プリカーサーm/z: 289.23663 |
| Splash: splash10-00di-0190000000-a12a8d228496be6b5401 |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 271.04 | 1947 | 18 | 1000 |
| 253.16 | 754 | 36 | 387 |
| 127.00 | 382 | 162 | 195 |
| 280.46 | 161 | 9 | 82 |
FlavonoidSearch結果
| Score | Symbolized Name | MSMS-Category | MSMS-Aglycone |
|---|---|---|---|
| 0.167 | [Dihydrochalcone]-A(3OH)-B(1OMe) | Dihydrochalcone | 2',4',6'-Trihydroxy-4-methoxydihydrochalcone |
| 0.143 | [Dihydroflavonol]-A(1OH)-B(2OH) | Dihydroflavonol | Fustin |
| 0.143 | [Dihydroflavonol]-A(2OH)-B(1OH) | Dihydroflavonol | 3,5,7,2'-Tetrahydroxyflavanone |
| 0.091 | [Dihydroflavonol]-A(2OH)-B(1OH) | Dihydroflavonol | Aromadendrin |
| 0.083 | [2'-Hydroxychalcone]-A(3OH)-B(2OH) | 2'-Hydroxychalcone | 3,4,2',4',6'-Pentahydroxychalcone |
| 0.083 | [Isoflavanone]-A(2OH)-B(2OH) | Isoflavanone | Dalbergioidin |
| 0.077 | [Flavanone]-A(2OH)-B(2OH) | Flavanone | 5,7,2',6'-Tetrahydroxyflavanone |
| 0.077 | [Flavanone]-A(2OH)-B(2OH) | Flavanone | 5,7,2',5'-Tetrahydroxyflavanone |
| 0.077 | [Flavanone]-A(2OH)-B(2OH) | Flavanone | Eriodictyol |
| 0.077 | [Flavanone]-A(2OH)-B(2OH) | Flavanone | Steppogenin |
| 0.077 | [Flavanone]-A(3OH)-B(1OH) | Flavanone | Carthamidin |
| 0.077 | [Flavanone]-A(3OH)-B(1OH) | Flavanone | Isocarthamidin |
| 0.067 | [2'-Hydroxychalcone]-A(2OH)-B(3OH) | 2'-Hydroxychalcone | Robtein |
| 0.067 | [2'-Hydroxychalcone]-A(3OH)-B(2OH) | 2'-Hydroxychalcone | Neoplathymenin |
| 0.067 | [2'-Hydroxychalcone]-A(3OH)-B(2OH) | 2'-Hydroxychalcone | Okanin |
| 0.063 | [Flavanone]-A(2OH)-B(2OH) | Flavanone | Plathymenin |
| 0.063 | [Flavanone]-A(2OH)-B(2OH) | Flavanone | Isookanin |
| 0.000 | [Dihydrochalcone]-A(1OH)-B(2OH, 1OMe) | Dihydrochalcone | Loureirin D |
| 0.000 | [Dihydrochalcone]-A(2OH, 1OMe)-B(1OH) | Dihydrochalcone | Asebogenin |
| 0.000 | [Dihydrochalcone]-A(2OH, 1OMe)-B(1OH) | Dihydrochalcone | 4,2',4'-Trihydroxy-6'-methoxydihydrochalcone |
| 0.000 | [Dihydrochalcone]-A(1OH, 1OMe)-B(2OH) | Dihydrochalcone | Dihydrocalythropsin |
| 0.000 | [Dihydrochalcone]-A(2OH)-B(1OH, 1OMe) | Dihydrochalcone | 4,2',4'-Trihydroxy-3-methoxydihydrochalcone |
| 0.000 | [Auronol]-A(1OH)-B(2OH) | Auronol | 2,6,3',4'-Tetrahydroxy-2-benzylcoumaranone |
| 0.000 | [Auronol]-A(2OH)-B(1OH) | Auronol | Maesopsin |
| 0.000 | [alpha-Hydroxychalcone]-A(2OH)-B(2OH) | alpha-Hydroxychalcone | 3,4,2',4',alpha-Pentahydroxychalcone |
| 0.000 | [Dihydrochalcone alpha-ol]-A(1OH, 1OMe)-B(1OH) | Dihydrochalcone alpha-ol | 4,4',alpha-Trihydroxy-2'-methoxydihydrochalcone |
| 0.000 | [Dihydrochalcone alpha-ol]-A(2OH)-B(1OMe) | Dihydrochalcone alpha-ol | 2',4',alpha-Trihydroxy-4-methoxydihydrochalcone |
| 0.000 | [2-Hydroxyflavanone]-A(2OH)-B(1OH) | 2-Hydroxyflavanone | 2,5,7,4'-Tetrahydroxyflavanone |
| 0.000 | [CCS-type derivative / [4,2']-Epoxyflavan 3-ol]-A(2OH)-B(1OH) | CCS-type derivative / [4,2']-Epoxyflavan 3-ol | Cyanomaclurin |
| 0.000 | [CCS-type derivative / [4,2']-Epoxyflavan 3-ol]-A(1OH)-B(2OH) | CCS-type derivative / [4,2']-Epoxyflavan 3-ol | 6,12-Mehthano-6H,12H-dibenzo[b,f][1,5]dioxocin-2,3,9,13-tetrol |
| 0.000 | [Flavan]-A(1OH)-B(2OH, 1OMe) | Flavan | 7,3',5'-Trihydroxy-4'-methoxyflavan |
| Level: 3, プリカーサーm/z: 271.03659 |
| Splash: splash10-0udi-0490000000-512c9e99d2c66592e480 |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 253.30 | 118 | 18 | 1000 |
| 211.03 | 31 | 60 | 263 |
| 169.02 | 27 | 102 | 229 |
| 222.95 | 16 | 48 | 138 |
| 165.04 | 14 | 106 | 118 |
| 205.02 | 13 | 66 | 111 |
| 138.73 | 12 | 132 | 99 |
| 159.07 | 11 | 112 | 92 |
| 182.81 | 9 | 88 | 75 |
| 151.12 | 9 | 120 | 72 |
| 209.09 | 8 | 62 | 69 |
| 144.88 | 7 | 126 | 60 |
| 234.86 | 6 | 36 | 52 |
FlavonoidSearch結果
| Score | Symbolized Name | MSMS-Category | MSMS-Aglycone |
|---|---|---|---|
| 0.158 | [2'-Hydroxychalcone]-A(1OH, 1OMe)-B(1OH) | 2'-Hydroxychalcone | Isoliquiritigenin 4'-methyl ether |
| 0.143 | [Chalcone]-A(1OH, 1OMe)-B(1OH) | Chalcone | Isoliquiritigenin 2'-methy ether |
| 0.143 | [Flavone]-A(3OH)-B(none) | Flavone | Baicalein |
| 0.143 | [Flavone]-A(3OH)-B(none) | Flavone | Norwogonin |
| 0.143 | [Flavanone]-A(1OMe)-B(1OH) | Flavanone | Methyl-liquiritigenin |
| 0.143 | [Anthocyanidin]-A(2OH)-B(1OH) | Anthocyanidin | Pelargonidin |
| 0.136 | [Isoflavone]-A(2OH)-B(1OH) | Isoflavone | Demethyltexasin |
| 0.136 | [Isoflavone]-A(2OH)-B(1OH) | Isoflavone | 8-Hydroxydaidzein |
| 0.136 | [Isoflavone]-A(2OH)-B(1OH) | Isoflavone | 5,7,2'-Trihydroxyisoflavone |
| 0.136 | [Isoflavone]-A(2OH)-B(1OH) | Isoflavone | 5,7,3'-Trihydroxyisoflavone |
| 0.136 | [Isoflavone]-A(2OH)-B(1OH) | Isoflavone | Genistein |
| 0.111 | [Flavonol]-A(2OH)-B(none) | Flavonol | Galangin |
| 0.100 | [2'-Hydroxychalcone]-A(2OH)-B(1OMe) | 2'-Hydroxychalcone | Isoliquiritigenin 4-methyl ether |
| 0.100 | [2'-Hydroxychalcone]-A(2OH)-B(1OMe) | 2'-Hydroxychalcone | 2',5'-Dihydroxy-4-methoxychalcone |
| 0.100 | [2'-Hydroxychalcone]-A(2OH, 1OMe)-B(none) | 2'-Hydroxychalcone | Flemichapparin |
| 0.100 | [2'-Hydroxychalcone]-A(2OH, 1OMe)-B(none) | 2'-Hydroxychalcone | Larrein |
| 0.100 | [2'-Hydroxychalcone]-A(2OH, 1OMe)-B(none) | 2'-Hydroxychalcone | Cardamonin |
| 0.100 | [2'-Hydroxychalcone]-A(2OH, 1OMe)-B(none) | 2'-Hydroxychalcone | 2',6'-Dihydroxy-4'-methoxychalcone |
| 0.091 | [Flavone]-A(2OH)-B(1OH) | Flavone | 5,8,2'-Trihydroxyflavone |
| 0.091 | [Flavone]-A(2OH)-B(1OH) | Flavone | 5,7,2'-Trihydroxyflavone |
| 0.091 | [Flavone]-A(2OH)-B(1OH) | Flavone | Apigenin |
| 0.091 | [Flavone]-A(1OH)-B(2OH) | Flavone | 7,3',4'-Trihydroxyflavone |
| 0.091 | [Flavone]-A(1OH)-B(2OH) | Flavone | 5,2',5'-Trihydroxyflavone |
| 0.091 | [Chalcone]-A(1OH)-B(1OH, 1OMe) | Chalcone | Echinatin |
| 0.091 | [Flavanone]-A(1OH)-B(1OMe) | Flavanone | 4'-Methylliquiritigenin |
| 0.091 | [Flavanone]-A(1OH, 1OMe)-B(none) | Flavanone | 7-Hydroxy-8-methoxyflavanone |
| 0.091 | [Flavanone]-A(1OH, 1OMe)-B(none) | Flavanone | Alpinetin |
| 0.091 | [Flavanone]-A(1OH, 1OMe)-B(none) | Flavanone | Pinostrobin |
| 0.087 | [Isoflavone]-A(1OH)-B(2OH) | Isoflavone | 3'-Hydroxydaidzein |
| 0.087 | [Isoflavone]-A(1OH)-B(2OH) | Isoflavone | 2'-Hydroxydaidzein |
| 0.069 | [Flavonol]-A(1OH)-B(1OH) | Flavonol | Resokaempferol |
| 0.048 | [Isoflavanone]-A(1OH)-B(1OMe) | Isoflavanone | Dihydroformononetin |
| 0.000 | [Pterocarpan]-A(1OH)-B(1OMe) | Pterocarpan | Medicarpin |
| 0.000 | [Pterocarpan]-A(1OMe)-B(1OH) | Pterocarpan | Isomedicarpin |
| 0.000 | [Aurone]-A(1OH)-B(2OH) | Aurone | Sulfuretin |
| 0.000 | [Aurone]-A(2OH)-B(1OH) | Aurone | 4,6,4'-Trihydroxyaurone |
| 0.000 | [UBR-type derivative / 2',5'-Dioxo-3'-cyclopentenyl-type Calcone (alpha-OMe)]-A(1OMe)-B(none) | UBR-type derivative / 2',5'-Dioxo-3'-cyclopentenyl-type Calcone | Methyllucidone |
| 0.000 | [UBR-type derivative / 3',5'-Dioxo-1'-cyclopentenyl-type Dihydrocalcone]-A(3Methyl)-B(none) | UBR-type derivative / 3',5'-Dioxo-1'-cyclopentenyl-type Dihydrocalcone | 4-Hydrocinnamoyl-2,2,5-trimethyl-4-cyclopentene-1,3-dione |
| 0.000 | [Flavanone]-A(2OH, 1Methyl)-B(none) | Flavanone | Strobopinin |
| 0.000 | [Flavanone]-A(2OH, 1Methyl)-B(none) | Flavanone | Cryptostrobin |
| 0.000 | [Flavan]-A(1OMe, 1Methyl)-B(1OH) | Flavan | 4'-Hydroxy-7-methoxy-8-methylflavan |
| 0.000 | [Flavan]-A(1OH)-B(1([@@]-Methylenedioxy)) | Flavan | 7-Hydroxy-3',4'-methylenedioxyflavan |
| 0.000 | [Flavan]-A(2OMe)-B(none) | Flavan | Tephrowatsin E |
| 0.000 | [Flavan]-A(1OH, 1OMe, 1Methyl)-B(none) | Flavan | 7-Hydroxy-5-methoxy-6-methylflavan |
| 0.000 | [3-DehydroxyAnthocyanidin]-A(2OH)-B(2OH) | 3-DehydroxyAnthocyanidin | Luteolinidin |
| 0.000 | [isoflavene]-A(1OH)-B(1OH, 1OMe) | isoflavene | Haginin B |
| 0.000 | [2-Phenylbenzofuran]-A(1OMe)-B(1OH, 1OMe) | 2-Phenylbenzofuran | Vignafuran |
| 0.000 | [2-Phenylbenzofuran]-A(1([@@]-Methylenedioxy))-B(2OH) | 2-Phenylbenzofuran | 2',4'-Dihydroxy-5,6-methylenedioxy-2-phenylbenzofuran |
| 0.000 | [Dalbergiquinol]-A(1OH, 2OMe)-B(none) | Dalbergiquinol | 5-Hydroxy-2,4-dimethoxydalbergiquinol |
| 0.000 | [UBR-type derivative / [2,5]-Benzoquinonyl-type Dalbergiquinol]-A(1OMe)-B(1OH) | UBR-type derivative / [2,5]-Benzoquinonyl-type Dalbergiquinol | 4'-Hydroxy-4-methoxydalbergione |
| Level: 3, プリカーサーm/z: 253.16144 |
| Splash: splash10-07br-0490000000-2c5d330f7c646cd6dd36 |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 235.27 | 21 | 18 | 1000 |
| 217.50 | 18 | 36 | 870 |
| 243.88 | 12 | 9 | 584 |
| 209.01 | 10 | 44 | 468 |
| 111.14 | 9 | 142 | 415 |
| 137.31 | 7 | 116 | 350 |
| 163.65 | 6 | 90 | 295 |
| 205.22 | 6 | 48 | 290 |
| 128.93 | 6 | 124 | 263 |
| 211.02 | 5 | 42 | 250 |
| 165.12 | 5 | 88 | 248 |
| 270.82 | 3 | -18 | 147 |
| 170.70 | 2 | 82 | 114 |
FlavonoidSearch結果
| Score | Symbolized Name | MSMS-Category | MSMS-Aglycone |
|---|---|---|---|
| 0.067 | [Flavone]-A(1OMe)-B(none) | Flavone | 7-Methoxyflavone |
| 0.067 | [Flavone]-A(1OMe)-B(none) | Flavone | 6-Methoxyflavone |
| 0.000 | [2-substituted Isoflavone (2-Methyl)]-A(1OH)-B(none) | 2-substituted Isoflavone | 7-Hydroxy-2-methylisoflavone |