ピーク情報

トマト Micro-Tom 成熟果実の果皮

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Peak #9458 MN MID: SE203_S11_M90

m/z: 271.22667, RT: 65.05, 強度: 2571, ログ強度: -0.16, アダクト: [M-H2O+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: 0.091, MS3: -

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	-0.339	4,12-dihydroxy-hexadecanoic acid	LipidMAPS: LMFA01050189
C16H32O4	288.23006	-0.339	MG(0:0/a-13:0/0:0)[rac]	HMDB: HMDB0072843
C16H32O4	288.23006	-0.339	9,10-dihydroxy-hexadecanoic acid	LipidMAPS: LMFA01050191
C16H32O4	288.23006	-0.339	3,16-dihydroxyhexadecanoic acid	LipidMAPS: LMFA01050487
C16H32O4	288.23006	-0.339	15,16-dihydroxy-hexadecanoic acid	LipidMAPS: LMFA01050084
C16H32O4	288.23006	-0.339	Ethyl seco-plakortide Z	KNApSAcK: C00049900, C00049904
C16H32O4	288.23006	-0.339	MG(0:0/13:0/0:0)	HMDB: HMDB0072861
C16H32O4	288.23006	-0.339	MG(0:0/i-13:0/0:0)	HMDB: HMDB0072870
C16H32O4	288.23006	-0.339	10,16-Dihydroxyhexadecanoic acid	HMDB: HMDB0037798 KEGG: C08285 KNApSAcK: C00007440 LipidMAPS: LMFA01050341
C16H32O4	288.23006	-0.339	MG(a-13:0/0:0/0:0)[rac]	HMDB: HMDB0072841
C16H32O4	288.23006	-0.339	MG(13:0/0:0/0:0)	HMDB: HMDB0072845
C16H32O4	288.23006	-0.339	3,12-dihydroxy-hexadecanoic acid	LipidMAPS: LMFA01050083
C16H32O4	288.23006	-0.339	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: 271.22662

Splash: splash10-0udi-0090000000-83dd88a2d8f974b66f51

m/z	Int.	NL	Rel.Int.
253.10	3176	18	1000
235.15	984	36	309
217.23	258	54	81

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.091	[Isoflavanone]-A(1OH)-B(1OMe)	Isoflavanone	Dihydroformononetin
0.091	[2'-Hydroxychalcone]-A(1OH, 1OMe)-B(1OH)	2'-Hydroxychalcone	Isoliquiritigenin 4'-methyl ether
0.091	[2'-Hydroxychalcone]-A(2OH)-B(1OMe)	2'-Hydroxychalcone	Isoliquiritigenin 4-methyl ether
0.091	[2'-Hydroxychalcone]-A(2OH)-B(1OMe)	2'-Hydroxychalcone	2',5'-Dihydroxy-4-methoxychalcone
0.091	[2'-Hydroxychalcone]-A(2OH, 1OMe)-B(none)	2'-Hydroxychalcone	Flemichapparin
0.091	[2'-Hydroxychalcone]-A(2OH, 1OMe)-B(none)	2'-Hydroxychalcone	Larrein
0.091	[2'-Hydroxychalcone]-A(2OH, 1OMe)-B(none)	2'-Hydroxychalcone	Cardamonin
0.091	[2'-Hydroxychalcone]-A(2OH, 1OMe)-B(none)	2'-Hydroxychalcone	2',6'-Dihydroxy-4'-methoxychalcone
0.077	[Flavone]-A(2OH)-B(1OH)	Flavone	5,8,2'-Trihydroxyflavone
0.077	[Flavone]-A(2OH)-B(1OH)	Flavone	5,7,2'-Trihydroxyflavone
0.077	[Flavone]-A(2OH)-B(1OH)	Flavone	Apigenin
0.077	[Flavone]-A(3OH)-B(none)	Flavone	Baicalein
0.077	[Flavone]-A(3OH)-B(none)	Flavone	Norwogonin
0.077	[Flavone]-A(1OH)-B(2OH)	Flavone	7,3',4'-Trihydroxyflavone
0.077	[Flavone]-A(1OH)-B(2OH)	Flavone	5,2',5'-Trihydroxyflavone
0.077	[Chalcone]-A(1OH)-B(1OH, 1OMe)	Chalcone	Echinatin
0.077	[Chalcone]-A(1OH, 1OMe)-B(1OH)	Chalcone	Isoliquiritigenin 2'-methy ether
0.077	[Anthocyanidin]-A(2OH)-B(1OH)	Anthocyanidin	Pelargonidin
0.077	[Flavanone]-A(1OH)-B(1OMe)	Flavanone	4'-Methylliquiritigenin
0.077	[Flavanone]-A(1OMe)-B(1OH)	Flavanone	Methyl-liquiritigenin
0.077	[Flavanone]-A(1OH, 1OMe)-B(none)	Flavanone	7-Hydroxy-8-methoxyflavanone
0.077	[Flavanone]-A(1OH, 1OMe)-B(none)	Flavanone	Alpinetin
0.077	[Flavanone]-A(1OH, 1OMe)-B(none)	Flavanone	Pinostrobin
0.071	[Isoflavone]-A(2OH)-B(1OH)	Isoflavone	Demethyltexasin
0.071	[Isoflavone]-A(2OH)-B(1OH)	Isoflavone	8-Hydroxydaidzein
0.071	[Isoflavone]-A(2OH)-B(1OH)	Isoflavone	5,7,2'-Trihydroxyisoflavone
0.071	[Isoflavone]-A(2OH)-B(1OH)	Isoflavone	5,7,3'-Trihydroxyisoflavone
0.071	[Isoflavone]-A(2OH)-B(1OH)	Isoflavone	Genistein
0.071	[Isoflavone]-A(1OH)-B(2OH)	Isoflavone	3'-Hydroxydaidzein
0.071	[Isoflavone]-A(1OH)-B(2OH)	Isoflavone	2'-Hydroxydaidzein
0.053	[Flavonol]-A(2OH)-B(none)	Flavonol	Galangin
0.050	[Flavonol]-A(1OH)-B(1OH)	Flavonol	Resokaempferol
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: 253.13104

Splash: splash10-00kr-0190000000-324aae29174cb4a38711

m/z	Int.	NL	Rel.Int.
235.17	579	18	1000
217.17	337	36	581
165.12	57	88	98
121.07	46	132	78
175.04	43	78	74
150.96	42	102	72
97.02	39	156	68
225.22	30	28	51

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Flavone]-A(1OMe)-B(none)	Flavone	7-Methoxyflavone
[Flavone]-A(1OMe)-B(none)	Flavone	6-Methoxyflavone
[2-substituted Isoflavone (2-Methyl)]-A(1OH)-B(none)	2-substituted Isoflavone	7-Hydroxy-2-methylisoflavone

Level: 3, プリカーサーm/z: 235.12889

Splash: splash10-014i-0490000000-ecc9b8371f9c43912b08

ピーク番号	保持時間 (min)	m/z	m/z差分	ログ強度	アダクト	DB検索結果	ヒット数	MSn	FS2	FS3	共有数
	65.04	289.23726	18.0106	0.46	[M+H]+	(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...	ALL 13 KG 1 KN 1 HM 5 LM 6	MS2 MS3	0.154	0.143	6
9458	65.05	271.22667	0.0000	-0.16	[M-H2O+H]+	(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...	ALL 13 KG 1 KN 1 HM 5 LM 6	MS2 MS3 x 2	0.091		1

m/z	Int.	NL	Rel.Int.
217.14	313	18	1000
120.99	56	114	179
135.07	42	100	133
147.09	21	88	66
161.25	18	74	57
112.92	17	122	53

ピーク情報

DB検索結果

MSnスペクトル情報

FlavonoidSearch結果

FlavonoidSearch結果

FlavonoidSearch結果

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