ピーク情報

＜コーヒー・ココア類＞コーヒー浸出液

pos

Peak #1966 MN MID: SE118_S160451_M90

m/z: 295.16510, RT: 26.99, 強度: 2520, ログ強度: -0.08, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 2

DB検索結果: (5 names) Tyrosyl-Leucine;Isoleucyl-Tyrosine;Tyrosyl-Isoleucine;Sinapoylputrescine;Leucyl-Tyrosine

DBごとのヒット数: ALL 5 HM 5

FlavonoidSearch最大スコア MS2: -, 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
C15H22O4N2	294.15796	-0.439	Tyrosyl-Leucine	HMDB: HMDB0029109
C15H22O4N2	294.15796	-0.439	N-(deca-2E,4Z,7Z-trienoyl)-L-glutamine	LipidMAPS: LMFA08020410, LMFA08020411
C15H22O4N2	294.15796	-0.439	Isoleucyl-Tyrosine	HMDB: HMDB0028919
C15H22O4N2	294.15796	-0.439	Tyrosyl-Isoleucine	HMDB: HMDB0029108
C15H22O4N2	294.15796	-0.439	Sinapoylputrescine	HMDB: HMDB0033464
C15H22O4N2	294.15796	-0.439	Leucyl-Tyrosine	HMDB: HMDB0028941

Level: 2, プリカーサーm/z: 295.16473

Splash: splash10-004i-0980000000-c791c1fe07583e8c303d

m/z	Int.	NL	Rel.Int.
175.06	2445	120	1000
277.19	2070	18	846
249.14	592	46	242
130.04	450	165	183
250.13	285	45	116
204.07	224	91	91
129.12	193	166	79
120.93	153	174	62
83.98	149	211	60

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Auronol (2-OMe)]-A(1([2,3:@@]-Furano))-B(none)	Auronol	Castillene A
[beta-Hydroxy(or Oxodihydro)chalcone]-A(1OMe, 1Oxo, 1([2,3:@@]-Furano))-B(none)	beta-Hydroxy(or Oxodihydro)chalcone	Pongamol
[Flavanone]-A(1OMe, 1([2,3:@@]-Furano))-B(none)	Flavanone	6-Methoxy-[2'',3'':7,8]furanoflavanone
[Dihydroflavonol (3-OMe)]-A(1([2,3:@@]-Furano))-B(none)	Dihydroflavonol	3-Methoxy-[2'',3'':7,8]furanoflavanone
[2-substituted Isoflavone (2-Methyl)]-A(1OH, 1Acetyl)-B(none)	2-substituted Isoflavone	Glyzarin
[Pterocarpan]-A(1([2,3:@@]-Furano))-B(1OMe)	Pterocarpan	9-O-Methylneodunol

Level: 3, プリカーサーm/z: 175.06380

Splash: splash10-001i-0900000000-743d8e2bff421c8eed07

m/z	Int.	NL	Rel.Int.
130.04	1433	45	1000
83.98	150	91	104

Level: 3, プリカーサーm/z: 277.18655

Splash: splash10-0002-2290000000-2deac913ba999bf1d38e

m/z	Int.	NL	Rel.Int.
249.14	393	28	1000
98.10	140	179	356
259.20	106	18	268
114.03	91	163	232
203.99	89	73	227
130.03	55	147	140
233.23	53	44	133
188.15	37	89	94
232.28	33	45	84
83.92	23	193	58
231.09	23	46	57