ピーク情報

＜茶類＞（発酵茶類）紅茶茶

pos

Peak #3590 MN MID: SE120_S160431_M90

m/z: 275.09141, RT: 43.62, 強度: 101574, ログ強度: 1.46, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 11

DB検索結果: (48 names) Methysticin;4,2',4',alpha-Tetrahydroxydihydrochalcone;delta-Cotonefuran;Fomajorin S;beta-Pyrufuran;6,3'-Dihydroxy-2,4-dimethoxybenzophenone;Ptaerochromenol;11-Hydroxyyangonin;(R)-7,8-dihydroxy-alpha-d...

DBごとのヒット数: ALL 41 KG 11 KN 21 HM 9

FlavonoidSearch最大スコア MS2: 0.600, 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
C15H14O5	274.08412	0.045	Methysticin	HMDB: HMDB0033590, HMDB0254671 KEGG: C09952 KNApSAcK: C00003005
C15H14O5	274.08412	0.045	4,2',4',alpha-Tetrahydroxydihydrochalcone	FlavonoidViewer: FL1DHXNS0003 KNApSAcK: C00007947 LipidMAPS: LMPK12120575
C15H14O5	274.08412	0.045	delta-Cotonefuran	KNApSAcK: C00047843
C15H14O5	274.08412	0.045	Fomajorin S	KNApSAcK: C00021486
C15H14O5	274.08412	0.045	beta-Pyrufuran	HMDB: HMDB0030634 KEGG: C08948 KNApSAcK: C00002407
C15H14O5	274.08412	0.045	6,3'-Dihydroxy-2,4-dimethoxybenzophenone	KNApSAcK: C00044468
C15H14O5	274.08412	0.045	11-Hydroxyyangonin	HMDB: HMDB0033017
C15H14O5	274.08412	0.045	Ptaerochromenol	KEGG: C09029 KNApSAcK: C00002441
C15H14O5	274.08412	0.045	(R)-7,8-dihydroxy-alpha-dunnione	KNApSAcK: C00042015
C15H14O5	274.08412	0.045	Afzelechin	FlavonoidViewer: FL63AANS0001, FL63AANS0002, FL63AANS0003 HMDB: HMDB0030822, HMDB0030823 KEGG: C09320, C12128 KNApSAcK: C00000937, C00008805, C00008806 LipidMAPS: LMPK12020035, LMPK12020036, LMPK12020037
C15H14O5	274.08412	0.045	6'-Hydroxy-O-desmethylangolensin	HMDB: HMDB0041695 KEGG: C22560
C15H14O5	274.08412	0.045	Umtatin	KNApSAcK: C00035893
C15H14O5	274.08412	0.045	Phebaclavin C	KNApSAcK: C00045364
C15H14O5	274.08412	0.045	5-(3-Methyl-2-butenyloxy)-6,7-methylenedioxycoumarin	KNApSAcK: C00019962
C15H14O5	274.08412	0.045	Fisetinidol	FlavonoidViewer: FL631CNS0001, FL631CNS0002, FL631CNS0003 HMDB: HMDB0030541 KEGG: C09735 KNApSAcK: C00008822, C00008823, C00008824 LipidMAPS: LMPK12020013, LMPK12020014, LMPK12020015
C15H14O5	274.08412	0.045	Ficuformodiol A	KNApSAcK: C00035308
C15H14O5	274.08412	0.045	Ficuformodiol B	KNApSAcK: C00035309
C15H14O5	274.08412	0.045	3,3',5,5'-Tetrahydroxy-4-methoxystilbene	HMDB: HMDB0030377 KNApSAcK: C00015561
C15H14O5	274.08412	0.045	alpha-Pyrufuran	HMDB: HMDB0030635 KEGG: C08929 KNApSAcK: C00002406
C15H14O5	274.08412	0.045	Apiferol	FlavonoidViewer: FL64AANS0001 HMDB: HMDB0037232 KEGG: C12124 KNApSAcK: C00008975 LipidMAPS: LMPK12020166
C15H14O5	274.08412	0.045	5'-Hydroxy-O-desmethylangolensin	HMDB: HMDB0041685
C15H14O5	274.08412	0.045	Luteoliflavan	KEGG: C12122
C15H14O5	274.08412	0.045	Greveichromenol	KNApSAcK: C00030428
C15H14O5	274.08412	0.045	Mikacynancholide	KNApSAcK: C00012938
C15H14O5	274.08412	0.045	5-Acetoxyisogoniothalamin oxide	KNApSAcK: C00036591
C15H14O5	274.08412	0.045	Corymbiferan lactone D	KNApSAcK: C00043410
C15H14O5	274.08412	0.045	3'-Hydroxy-O-desmethylangolensin	HMDB: HMDB0041654
C15H14O5	274.08412	0.045	Eranthin	KNApSAcK: C00055840
C15H14O5	274.08412	0.045	11-Methoxynoryangonin	HMDB: HMDB0030754
C15H14O5	274.08412	0.045	Hydroxysesamone	HMDB: HMDB0037760
C15H14O5	274.08412	0.045	2,3-Epoxysesamone	HMDB: HMDB0033333
C15H14O5	274.08412	0.045	5,6-Dehydro-7,8-dihydromethysticin	KNApSAcK: C00043208
C15H14O5	274.08412	0.045	Phloretin	FlavonoidViewer: FL1DAANS0001 HMDB: HMDB0003306 KEGG: C00774 KNApSAcK: C00007936 LipidMAPS: LMPK12120525
C15H14O5	274.08412	0.045	Wyerone epoxide	HMDB: HMDB0030949
C15H14O5	274.08412	0.045	Guibourtinidol-4alpha-ol	FlavonoidViewer: FL6D1ANS0001, FL6D1ANS0002, FL6D1ANS0003 HMDB: HMDB0040828 KEGG: C16415 KNApSAcK: C00008993, C00008994, C00008995, C00020071 LipidMAPS: LMPK12020175, LMPK12020176, LMPK12020177
C15H14O5	274.08412	0.045	Miscandenin	KNApSAcK: C00012046
C15H14O5	274.08412	0.045	H37	KEGG: C13767
C15H14O5	274.08412	0.045	Hemigossypolone	HMDB: HMDB0030744
C15H14O5	274.08412	0.045	Lecanorin	KNApSAcK: C00046797
C15H14O5	274.08412	0.045	Avicequinone A	KNApSAcK: C00032748
C15H14O5	274.08412	0.045	Anhydroscandenolide	KNApSAcK: C00012357

MSnスペクトル情報

Level: 2, プリカーサーm/z: 275.09094

Splash: splash10-000i-0900000000-fd538495346d2a8aa311

m/z	Int.	NL	Rel.Int.
138.91	285727	136	1000
149.02	103294	126	361
106.95	15782	168	55

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.600	[Flavan 3-ol]-A(2OH)-B(1OH)	Flavan 3-ol	Afzelechin
0.500	[Dihydrochalcone]-A(3OH)-B(1OH)	Dihydrochalcone	Phloretin
0.000	[Flavan 3-ol]-A(1OH)-B(2OH)	Flavan 3-ol	Fisetinidol
0.000	[Auronol]-A(none)-B(1Cl)	Auronol	4'-Chloro-2-hydroxyaurone
0.000	[Dihydrochalcone alpha-ol]-A(2OH)-B(1OH)	Dihydrochalcone alpha-ol	4,2',4',alpha-Tetrahydroxydihydrochalcone
0.000	[Dihydrochalcone beta-ol]-A(2OH)-B(1OH)	Dihydrochalcone beta-ol	4,2',4',beta-Tetrahydroxydihydrochalcone
0.000	[Flavan 4-ol]-A(2OH)-B(1OH)	Flavan 4-ol	Apifero
0.000	[Flavan 3,4-diol]-A(1OH)-B(1OH)	Flavan 3,4-diol	3,4,7,4'-Tetrahydroxyflavan
0.000	[Flavan]-A(2OH)-B(2OH)	Flavan	5,7,3',4'-Tetrahydroxyflavan

Level: 3, プリカーサーm/z: 149.02246

Splash: splash10-0kmi-0900000000-98ab1339bd47ab525460

m/z	Int.	NL	Rel.Int.
120.96	10896	28	1000
103.00	8720	46	800
106.94	5450	42	500
130.94	2690	18	246

Level: 3, プリカーサーm/z: 138.90955

Splash: splash10-03di-2900000000-4db73a55b072fd00378d

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

m/z	Int.	NL	Rel.Int.
110.91	1885	28	1000
96.95	340	42	180
121.06	271	18	144
138.87	159	0	84
94.78	155	44	82
82.93	103	56	54