ピーク情報

タバコBY-2細胞　3日目

pos

Peak #63 MN MID: SE204_S03_M90

m/z: 265.11173, RT: 10.10, 強度: 4468, ログ強度: 0.00, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 1

DB検索結果: (3 names) Thiamine;2-(6'-methylthio)hexylmalate;3-(6'-methylthio)hexylmalate

DBごとのヒット数: ALL 3 KG 3

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
C12H16ON4S	264.10448	-0.117	Thiamine	HMDB: [1]HMDB0000235, [1f]HMDB0302835, [1f]HMDB0303167 KEGG: [1]C00378 KNApSAcK: [1]C00000775
C11H20O5S	264.10314	4.947	2-(6'-Methylthio)hexylmalic acid	HMDB: [-2]HMDB0304053 KEGG: C17226 KNApSAcK: C00007653
C11H20O5S	264.10314	4.947	3-(6'-Methylthio)hexylmalic acid	HMDB: [-2]HMDB0304111 KEGG: C17227

Level: 2, プリカーサーm/z: 265.11121

Splash: splash10-00dl-0900000000-c9e4925bfe85b661c4de

m/z	Int.	NL	Rel.Int.
121.92	15784	143	1000
143.90	8904	121	564

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.000	[2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-Furano))-B(none)	2'-Hydroxychalcone	2'-Hydroxyfurano[2'',3'':4',3']chalcone

Level: 3, プリカーサーm/z: 121.92169

Splash: splash10-001i-9100000000-374ae0ccb15e5b794bd2

m/z	Int.	NL	Rel.Int.
80.79	873	41	1000
121.97	105	-0	120

Level: 3, プリカーサーm/z: 143.90456

Splash: splash10-004i-0900000000-3fb09ac47c1755b11d46

m/z	Int.	NL	Rel.Int.
125.95	164	18	1000
143.75	13	0	79
112.89	10	31	61
113.81	8	30	50