ピーク情報

＜茶類＞（緑茶類）ほうじ茶浸出液

pos

Peak #1091 MN MID: SE120_S160401_M90

m/z: 291.08621, RT: 36.87, 強度: 3015, 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）: 34

DB検索結果: (46 names) Gerfelin;QN 22074-5A;Corynether A;gamma-Pyrufuran;Plumericin;Officinalin isobutyrate;Oritin-4beta-ol;Ptaeroglycol;Mikanolide;p-coumaroyltriacetate;Cartorimine;6-Hydroxy-alpha-pyrufuran;Photinide C;(+)...

DBごとのヒット数: ALL 38 KG 9 KN 23 HM 6

FlavonoidSearch最大スコア MS2: 0.833, 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
C15H14O6	290.07904	-0.361	Gerfelin	KNApSAcK: C00014943
C15H14O6	290.07904	-0.361	Corynether A	KNApSAcK: C00048364
C15H14O6	290.07904	-0.361	gamma-Pyrufuran	HMDB: HMDB0030131
C15H14O6	290.07904	-0.361	Oritin-4beta-ol	FlavonoidViewer: FL6D3ANS0001, FL6D3ANS0002, FL6D3ANS0003 KNApSAcK: C00009004, C00009005, C00009006 LipidMAPS: LMPK12020186, LMPK12020187, LMPK12020188
C15H14O6	290.07904	-0.361	Isoplumericin	KEGG: C09787, C09796 KNApSAcK: C00003087, C00003095
C15H14O6	290.07904	-0.361	Officinalin isobutyrate	KNApSAcK: C00035708
C15H14O6	290.07904	-0.361	p-coumaroyltriacetate	HMDB: [-1]HMDB0304446
C15H14O6	290.07904	-0.361	Ptaeroglycol	KEGG: C09030 KNApSAcK: C00002442
C15H14O6	290.07904	-0.361	Mikanolide	KEGG: C09511 KNApSAcK: C00003332
C15H14O6	290.07904	-0.361	Cartorimine	HMDB: HMDB0035399 KNApSAcK: C00046653
C15H14O6	290.07904	-0.361	6-Hydroxy-alpha-pyrufuran	HMDB: HMDB0041293
C15H14O6	290.07904	-0.361	Photinide C	KNApSAcK: C00048059, C00048060
C15H14O6	290.07904	-0.361	Javanicin	KNApSAcK: C00023706
C15H14O6	290.07904	-0.361	3,4,5,2',4'-Flavanpentol	KNApSAcK: C00020274
C15H14O6	290.07904	-0.361	Luteoforol	FlavonoidViewer: FL64ACNS0001 HMDB: HMDB0041310 KEGG: C05907 KNApSAcK: C00008977 LipidMAPS: LMPK12020170
C15H14O6	290.07904	-0.361	Nubigenol	FlavonoidViewer: FL1DHXNS0007 KEGG: C22565 KNApSAcK: C00007951 LipidMAPS: LMPK12120579
C15H14O6	290.07904	-0.361	Neoliacin	KNApSAcK: C00012321
C15H14O6	290.07904	-0.361	(S)-1,4-Dihydro-b,5-dihydroxy-3-methyl-1,4-dioxo-2-naphthalenebutanoic acid	KNApSAcK: C00016676
C15H14O6	290.07904	-0.361	Marshrin	HMDB: HMDB0033783
C15H14O6	290.07904	-0.361	Fisetinidol-4beta-ol	FlavonoidViewer: FL6D1CNS0001, FL6D1CNS0002, FL6D1CNS0003, FL6D1CNS0004, FL6D1CNS0005 KEGG: C09736 KNApSAcK: C00000962, C00008996, C00008997, C00008998, C00008999 LipidMAPS: LMPK12020178, LMPK12020179, LMPK12020180, LMPK12020181, LMPK12020182
C15H14O6	290.07904	-0.361	[3aR-(3aalpha,3bbeta,7aalpha,8aalpha,8bbeta,8cbeta,9abeta)]-3a,3b,7a,8a,8b,8c,9,9a-Octahydro-8b-methyl-3-methylene-5H-difuro[4,3,2-ef:3',2'-h]oxireno[a][3]benzoxepin-2,5(3H)-dione	KNApSAcK: C00012047
C15H14O6	290.07904	-0.361	Pleosporone	KNApSAcK: C00047335, C00048824
C15H14O6	290.07904	-0.361	Quinone A	HMDB: HMDB0257051
C15H14O6	290.07904	-0.361	(2R-cis)-2-(2,5-Dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triol	FlavonoidViewer: FL63A8NS0001 KNApSAcK: C00013249 LipidMAPS: LMPK12020022
C15H14O6	290.07904	-0.361	3,4,2',4',alpha-Pentahydroxydihydrochalcone	FlavonoidViewer: FL1DHXNS0008 KNApSAcK: C00014609 LipidMAPS: LMPK12120580
C15H14O6	290.07904	-0.361	epsilon-Cotonefuran	KNApSAcK: C00047862
C15H14O6	290.07904	-0.361	Mesquitol	FlavonoidViewer: FL633CNS0001 KNApSAcK: C00008827 LipidMAPS: LMPK12020021
C15H14O6	290.07904	-0.361	3-Hydroxyphloretin	FlavonoidViewer: FL1DACNS0001 HMDB: HMDB0029253 KEGG: C22567 KNApSAcK: C00007942 LipidMAPS: LMPK12120534
C15H14O6	290.07904	-0.361	2,8-Dihydroxy-3,4,7-trimethoxy-dibenzofuran	HMDB: HMDB0301847 KEGG: C08742 KNApSAcK: C00002396
C15H14O6	290.07904	-0.361	Corymbiferan lactone C	KNApSAcK: C00043409
C15H14O6	290.07904	-0.361	Leucopelargonidin	FlavonoidViewer: FL6DAANS0001 HMDB: HMDB0032322 KEGG: C03648 KNApSAcK: C00020638
C15H14O6	290.07904	-0.361	Fonsecin	HMDB: HMDB0034124 KNApSAcK: C00000559
C15H14O6	290.07904	-0.361	Altenusin	KNApSAcK: C00023666
C15H14O6	290.07904	-0.361	Catechin	FlavonoidViewer: FL63ACNS0001, FL63ACNS0002, FL63ACNS0003, FL63ACNS0004 HMDB: HMDB0001871, HMDB0002780, HMDB0037954 KEGG: C17590, C06562, C09727, C14079, C09728 KNApSAcK: C00000947, C00000956, C00000957, C00008808 LipidMAPS: LMPK12020001, LMPK12020003
C15H14O6	290.07904	-0.361	Robinetinidol	FlavonoidViewer: FL631GNS0001, FL631GNS0002 KNApSAcK: C00008825, C00008826 LipidMAPS: LMPK12020017, LMPK12020018
C15H14O6	290.07904	-0.361	(2R,3R)-3,5,7,3',5'-Pentahydroxyflavan	FlavonoidViewer: FL63A9NS0002 KNApSAcK: C00008828 LipidMAPS: LMPK12020024
C15H14O6	290.07904	-0.361	alpha-Cotonefuran	HMDB: HMDB0030144 KEGG: C08739 KNApSAcK: C00002393
C16H10O2N4	290.08038	-4.972	Ferene triazine	HMDB: HMDB0252233

MSnスペクトル情報

Level: 2, プリカーサーm/z: 291.08615

Splash: splash10-00dr-0900000000-246fa58c4849b1f4049b

m/z	Int.	NL	Rel.Int.
138.93	9815	152	1000
122.90	9725	168	990
164.91	4702	126	479
150.98	2597	140	264
273.06	1789	18	182
146.90	801	144	81

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.833	[Flavan 3-ol]-A(2OH)-B(2OH)	Flavan 3-ol	Mesquitol
0.833	[Flavan 3-ol]-A(2OH)-B(2OH)	Flavan 3-ol	2-(2,5-Dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triol
0.833	[Flavan 3-ol]-A(2OH)-B(2OH)	Flavan 3-ol	3,5,7,3',5'-Pentahydroxyflavan
0.833	[Flavan 3-ol]-A(2OH)-B(2OH)	Flavan 3-ol	Catechin
0.375	[Flavan 3-ol]-A(1OH)-B(3OH)	Flavan 3-ol	Robinetinidol
0.286	[Dihydrochalcone]-A(3OH)-B(2OH)	Dihydrochalcone	3,4,2',4',6'-Pentahydroxydihydrochalcone
0.000	[Dihydrochalcone alpha-ol]-A(3OH)-B(1OH)	Dihydrochalcone alpha-ol	Nubigenol
0.000	[Dihydrochalcone alpha-ol]-A(2OH)-B(2OH)	Dihydrochalcone alpha-ol	3,4,2',4',alpha-Pentahydroxydihydrochalcone
0.000	[Flavan 4-ol]-A(2OH)-B(2OH)	Flavan 4-ol	Luteoforol
0.000	[Flavan 3,4-diol]-A(1OH)-B(2OH)	Flavan 3,4-diol	3,4,7,3',4'-Pentahydroxyflavan
0.000	[Flavan 3,4-diol]-A(2OH)-B(1OH)	Flavan 3,4-diol	3,4,7,8,4'-Pentahydroxyflavan
0.000	[Flavan 3,4-diol]-A(2OH)-B(1OH)	Flavan 3,4-diol	3,4,5,7,4'-Pentahydroxyflavan

Level: 3, プリカーサーm/z: 138.98486

Splash: splash10-03di-3900000000-9c6916f83a3a0f829b58

m/z	Int.	NL	Rel.Int.
110.93	83	28	1000
66.75	27	72	330
96.86	8	42	98

Level: 3, プリカーサーm/z: 122.87590

Splash: splash10-0udi-4900000000-ed240c5a33ed84a3f3dc

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