ピーク情報

こめ［水稲穀粒］玄米

pos

Peak #3111 MN MID: SE122_S010801_M90

m/z: 638.53615, RT: 97.59, 強度: 6645, ログ強度: 0.43, アダクト: [M+ACN+H]+, 共有数（同様のピークを含むサンプル数）: 9

DB検索結果: (34 names) TG(8:0/8:0/17:0);TG(i-12:0/8:0/a-13:0)[rac];TG(8:0/8:0/a-17:0)[rac];TG(12:0/8:0/a-13:0)[rac];TG(10:0/8:0/15:0);TG(8:0/13:0/i-12:0);TG(12:0/8:0/i-13:0);TG(10:0/15:0/8:0);TG(12:0/8:0/13:0);TG(8:0/i-13:0...

DBごとのヒット数: ALL 34 HM 34

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
C36H68O6	596.50159	1.228	TG(8:0/8:0/17:0)	HMDB: HMDB0072345, HMDB0105196
C36H68O6	596.50159	1.228	TG(i-12:0/8:0/a-13:0)[rac]	HMDB: HMDB0094828, HMDB0096566
C36H68O6	596.50159	1.228	TG(8:0/8:0/a-17:0)[rac]	HMDB: HMDB0072121, HMDB0105194
C36H68O6	596.50159	1.228	TG(12:0/8:0/a-13:0)[rac]	HMDB: HMDB0094832, HMDB0096565
C36H68O6	596.50159	1.228	TG(10:0/8:0/15:0)	HMDB: HMDB0071972, HMDB0100889
C36H68O6	596.50159	1.228	TG(8:0/13:0/i-12:0)	HMDB: HMDB0072686, HMDB0095056
C36H68O6	596.50159	1.228	TG(12:0/8:0/i-13:0)	HMDB: HMDB0094831, HMDB0096568
C36H68O6	596.50159	1.228	TG(10:0/15:0/8:0)	HMDB: HMDB0071821, HMDB0072489
C36H68O6	596.50159	1.228	TG(12:0/8:0/13:0)	HMDB: HMDB0094830, HMDB0096569
C36H68O6	596.50159	1.228	TG(8:0/i-13:0/12:0)	HMDB: HMDB0071864, HMDB0095054
C36H68O6	596.50159	1.228	TG(10:0/a-15:0/8:0)[rac]	HMDB: HMDB0071456, HMDB0072420
C36H68O6	596.50159	1.228	TG(10:0/10:0/i-13:0)	HMDB: HMDB0071858, HMDB0096653
C36H68O6	596.50159	1.228	TG(8:0/13:0/12:0)	HMDB: HMDB0071277, HMDB0095057
C36H68O6	596.50159	1.228	TG(10:0/10:0/a-13:0)[rac]	HMDB: HMDB0072048, HMDB0096652
C36H68O6	596.50159	1.228	TG(10:0/8:0/a-15:0)[rac]	HMDB: HMDB0071925, HMDB0100887
C36H68O6	596.50159	1.228	TG(10:0/8:0/i-15:0)	HMDB: HMDB0072725, HMDB0100888
C36H68O6	596.50159	1.228	TG(10:0/10:0/13:0)	HMDB: HMDB0071616, HMDB0096654
C36H68O6	596.50159	1.228	TG(8:0/i-12:0/i-13:0)	HMDB: HMDB0072006, HMDB0096742
C36H68O6	596.50159	1.228	TG(8:0/i-12:0/a-13:0)[rac]	HMDB: HMDB0071223, HMDB0096741
C36H68O6	596.50159	1.228	TG(8:0/i-13:0/i-12:0)	HMDB: HMDB0071400, HMDB0095055
C36H68O6	596.50159	1.228	TG(10:0/i-15:0/8:0)	HMDB: HMDB0071842, HMDB0071928
C36H68O6	596.50159	1.228	TG(8:0/10:0/a-15:0)[rac]	HMDB: HMDB0071893, HMDB0100974
C36H68O6	596.50159	1.228	TG(8:0/12:0/i-13:0)	HMDB: HMDB0072166, HMDB0096743
C36H68O6	596.50159	1.228	TG(8:0/a-13:0/12:0)[rac]	HMDB: HMDB0072811, HMDB0095052
C36H68O6	596.50159	1.228	TG(8:0/8:0/i-17:0)	HMDB: HMDB0071439, HMDB0105195
C36H68O6	596.50159	1.228	TG(8:0/10:0/i-15:0)	HMDB: HMDB0072572, HMDB0100975
C36H68O6	596.50159	1.228	TG(i-12:0/8:0/i-13:0)	HMDB: HMDB0094827, HMDB0096567
C36H68O6	596.50159	1.228	TG(8:0/12:0/a-13:0)[rac]	HMDB: HMDB0071326, HMDB0096740
C36H68O6	596.50159	1.228	TG(i-12:0/8:0/13:0)	HMDB: HMDB0094829, HMDB0096570
C36H68O6	596.50159	1.228	TG(8:0/i-12:0/13:0)	HMDB: HMDB0072650, HMDB0096739
C36H68O6	596.50159	1.228	TG(8:0/10:0/15:0)	HMDB: HMDB0071845, HMDB0100976
C36H68O6	596.50159	1.228	TG(8:0/a-13:0/i-12:0)[rac]	HMDB: HMDB0072569, HMDB0095053
C36H68O6	596.50159	1.228	TG(8:0/12:0/13:0)	HMDB: HMDB0071508, HMDB0096744
C36H68O6	596.50159	1.228	Glycerol triundecanoate	HMDB: HMDB0031089

MSnスペクトル情報

Level: 2, プリカーサーm/z: 638.53400

Splash: splash10-0006-0029001000-7ba55e6f74eaa0865e6f

m/z	Int.	NL	Rel.Int.
340.30	2191	298	1000
358.38	799	280	364
298.43	456	340	208
280.30	397	358	181
620.67	394	18	179
322.39	258	316	117
619.98	140	19	64

Level: 3, プリカーサーm/z: 358.38214

Splash: splash10-0006-0009000000-ea77c87bdabd50aae923

m/z	Int.	NL	Rel.Int.
340.39	479	18	1000
322.28	51	36	106

Level: 3, プリカーサーm/z: 340.30389

Splash: splash10-0002-0091000000-655a70546c1f1146776a

m/z	Int.	NL	Rel.Int.
298.41	365	42	1000
280.31	213	60	582
263.29	175	77	479
322.30	171	18	467
245.31	68	95	185
196.04	31	144	83
161.09	21	179	58
175.25	21	165	57

関連ピーク情報

ピーク番号	保持時間 (min)	m/z	m/z差分	ログ強度	アダクト	DB検索結果	ヒット数	MSn	共有数
3111	97.59	638.53615	0.0000	0.43	[M+ACN+H]+	(34 names) TG(8:0/8:0/17:0); TG(i-12:0/8:0/a-13:0)[rac]; TG(8:0/8:0/a-17:0)[rac]; TG(12:0/8:0/a-13:0)[rac]; TG(10:0/8:0/15:0); TG(8:0/13:0/i-12:0); TG(12:0/8:0/i-13:0); TG(10:0/15:0/8:0); TG(12:0/8:0/13:0); TG(8:0/i-13:0...	ALL 34 HM 34	MS2 MS3 x 2	9
	97.59	597.50935	-41.0268	1.25	[M+H]+	(34 names) TG(8:0/8:0/17:0); TG(i-12:0/8:0/a-13:0)[rac]; TG(8:0/8:0/a-17:0)[rac]; TG(12:0/8:0/a-13:0)[rac]; TG(10:0/8:0/15:0); TG(8:0/13:0/i-12:0); TG(12:0/8:0/i-13:0); TG(10:0/15:0/8:0); TG(12:0/8:0/13:0); TG(8:0/i-13:0...	ALL 34 HM 34	MS2 MS3 x 2	15
	97.62	579.49885	-59.0373	0.58	[M-H2O+H]+	(34 names) TG(8:0/8:0/17:0); TG(i-12:0/8:0/a-13:0)[rac]; TG(8:0/8:0/a-17:0)[rac]; TG(12:0/8:0/a-13:0)[rac]; TG(10:0/8:0/15:0); TG(8:0/13:0/i-12:0); TG(12:0/8:0/i-13:0); TG(10:0/15:0/8:0); TG(12:0/8:0/13:0); TG(8:0/i-13:0...	ALL 34 HM 34		9

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

関連ピーク情報