ピーク情報

こめ［水稲めし］玄米

pos

Peak #32 MN MID: SE123_S010851_M90

m/z: 265.11165, RT: 10.50, 強度: 26999, ログ強度: 1.05, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 52

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	-0.401	Thiamine	HMDB: [1]HMDB0000235, [1f]HMDB0302835, [1f]HMDB0303167 KEGG: [1]C00378 KNApSAcK: [1]C00000775
C11H20O5S	264.10314	4.663	2-(6'-Methylthio)hexylmalic acid	HMDB: [-2]HMDB0304053 KEGG: C17226 KNApSAcK: C00007653
C11H20O5S	264.10314	4.663	3-(6'-Methylthio)hexylmalic acid	HMDB: [-2]HMDB0304111 KEGG: C17227

Level: 2, プリカーサーm/z: 265.11163

Splash: splash10-00dl-0900000000-141042a01255aae384af

m/z	Int.	NL	Rel.Int.
121.95	137197	143	1000
143.93	73811	121	537

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: 121.92116

Splash: splash10-001i-9100000000-aea178d4952935ec4f25

m/z	Int.	NL	Rel.Int.
80.98	4133	41	1000
122.04	795	-0	192

Level: 3, プリカーサーm/z: 143.95805

Splash: splash10-004i-0900000000-6f8451e94a51b68a6682

m/z	Int.	NL	Rel.Int.
125.94	735	18	1000
112.98	108	31	146
143.98	84	-0	113
114.02	76	30	103