ピーク情報

＜茶類＞（緑茶類）ほうじ茶浸出液

pos

Peak #1478 MN MID: SE120_S160401_M90

m/z: 275.09139, RT: 43.55, 強度: 1611, ログ強度: -0.16, 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	-0.030	Methysticin	HMDB: HMDB0033590, HMDB0254671 KEGG: C09952 KNApSAcK: C00003005
C15H14O5	274.08412	-0.030	4,2',4',alpha-Tetrahydroxydihydrochalcone	FlavonoidViewer: FL1DHXNS0003 KNApSAcK: C00007947 LipidMAPS: LMPK12120575
C15H14O5	274.08412	-0.030	delta-Cotonefuran	KNApSAcK: C00047843
C15H14O5	274.08412	-0.030	Fomajorin S	KNApSAcK: C00021486
C15H14O5	274.08412	-0.030	beta-Pyrufuran	HMDB: HMDB0030634 KEGG: C08948 KNApSAcK: C00002407
C15H14O5	274.08412	-0.030	6,3'-Dihydroxy-2,4-dimethoxybenzophenone	KNApSAcK: C00044468
C15H14O5	274.08412	-0.030	11-Hydroxyyangonin	HMDB: HMDB0033017
C15H14O5	274.08412	-0.030	Ptaerochromenol	KEGG: C09029 KNApSAcK: C00002441
C15H14O5	274.08412	-0.030	(R)-7,8-dihydroxy-alpha-dunnione	KNApSAcK: C00042015
C15H14O5	274.08412	-0.030	Afzelechin	FlavonoidViewer: FL63AANS0001, FL63AANS0002, FL63AANS0003 HMDB: HMDB0030822, HMDB0030823 KEGG: C09320, C12128 KNApSAcK: C00000937, C00008805, C00008806 LipidMAPS: LMPK12020035, LMPK12020036, LMPK12020037
C15H14O5	274.08412	-0.030	6'-Hydroxy-O-desmethylangolensin	HMDB: HMDB0041695 KEGG: C22560
C15H14O5	274.08412	-0.030	Umtatin	KNApSAcK: C00035893
C15H14O5	274.08412	-0.030	Phebaclavin C	KNApSAcK: C00045364
C15H14O5	274.08412	-0.030	5-(3-Methyl-2-butenyloxy)-6,7-methylenedioxycoumarin	KNApSAcK: C00019962
C15H14O5	274.08412	-0.030	Fisetinidol	FlavonoidViewer: FL631CNS0001, FL631CNS0002, FL631CNS0003 HMDB: HMDB0030541 KEGG: C09735 KNApSAcK: C00008822, C00008823, C00008824 LipidMAPS: LMPK12020013, LMPK12020014, LMPK12020015
C15H14O5	274.08412	-0.030	Ficuformodiol A	KNApSAcK: C00035308
C15H14O5	274.08412	-0.030	Ficuformodiol B	KNApSAcK: C00035309
C15H14O5	274.08412	-0.030	3,3',5,5'-Tetrahydroxy-4-methoxystilbene	HMDB: HMDB0030377 KNApSAcK: C00015561
C15H14O5	274.08412	-0.030	alpha-Pyrufuran	HMDB: HMDB0030635 KEGG: C08929 KNApSAcK: C00002406
C15H14O5	274.08412	-0.030	Apiferol	FlavonoidViewer: FL64AANS0001 HMDB: HMDB0037232 KEGG: C12124 KNApSAcK: C00008975 LipidMAPS: LMPK12020166
C15H14O5	274.08412	-0.030	5'-Hydroxy-O-desmethylangolensin	HMDB: HMDB0041685
C15H14O5	274.08412	-0.030	Luteoliflavan	KEGG: C12122
C15H14O5	274.08412	-0.030	Greveichromenol	KNApSAcK: C00030428
C15H14O5	274.08412	-0.030	Mikacynancholide	KNApSAcK: C00012938
C15H14O5	274.08412	-0.030	5-Acetoxyisogoniothalamin oxide	KNApSAcK: C00036591
C15H14O5	274.08412	-0.030	Corymbiferan lactone D	KNApSAcK: C00043410
C15H14O5	274.08412	-0.030	3'-Hydroxy-O-desmethylangolensin	HMDB: HMDB0041654
C15H14O5	274.08412	-0.030	Eranthin	KNApSAcK: C00055840
C15H14O5	274.08412	-0.030	11-Methoxynoryangonin	HMDB: HMDB0030754
C15H14O5	274.08412	-0.030	Hydroxysesamone	HMDB: HMDB0037760
C15H14O5	274.08412	-0.030	2,3-Epoxysesamone	HMDB: HMDB0033333
C15H14O5	274.08412	-0.030	5,6-Dehydro-7,8-dihydromethysticin	KNApSAcK: C00043208
C15H14O5	274.08412	-0.030	Phloretin	FlavonoidViewer: FL1DAANS0001 HMDB: HMDB0003306 KEGG: C00774 KNApSAcK: C00007936 LipidMAPS: LMPK12120525
C15H14O5	274.08412	-0.030	Wyerone epoxide	HMDB: HMDB0030949
C15H14O5	274.08412	-0.030	Guibourtinidol-4alpha-ol	FlavonoidViewer: FL6D1ANS0001, FL6D1ANS0002, FL6D1ANS0003 HMDB: HMDB0040828 KEGG: C16415 KNApSAcK: C00008993, C00008994, C00008995, C00020071 LipidMAPS: LMPK12020175, LMPK12020176, LMPK12020177
C15H14O5	274.08412	-0.030	Miscandenin	KNApSAcK: C00012046
C15H14O5	274.08412	-0.030	H37	KEGG: C13767
C15H14O5	274.08412	-0.030	Hemigossypolone	HMDB: HMDB0030744
C15H14O5	274.08412	-0.030	Lecanorin	KNApSAcK: C00046797
C15H14O5	274.08412	-0.030	Avicequinone A	KNApSAcK: C00032748
C15H14O5	274.08412	-0.030	Anhydroscandenolide	KNApSAcK: C00012357

MSnスペクトル情報

Level: 2, プリカーサーm/z: 275.09140

Splash: splash10-000i-0900000000-e61672780f96bd5f3ec5

m/z	Int.	NL	Rel.Int.
138.91	8185	136	1000
148.92	3146	126	384
257.10	414	18	50

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.600	[Flavan 3-ol]-A(2OH)-B(1OH)	Flavan 3-ol	Afzelechin
0.200	[Dihydrochalcone]-A(3OH)-B(1OH)	Dihydrochalcone	Phloretin
0.143	[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: 148.95407

Splash: splash10-0fk9-0900000000-840bed76f6552279ea9c

m/z	Int.	NL	Rel.Int.
120.93	277	28	1000
102.93	153	46	553
106.97	99	42	358
131.01	48	18	172

Level: 3, プリカーサーm/z: 138.89665

Splash: splash10-03di-4900000000-6a120bc49794a2c85711

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.
110.88	64	28	1000
96.89	10	42	163
82.87	9	56	148
94.87	4	44	66
64.79	4	74	64
54.55	4	84	59