ピーク情報

シロイヌナズナ　地上部

pos

Peak #12243 MN MID: SE200_S1_M90

m/z: 858.55929, RT: 97.47, 強度: 393779, ログ強度: 1.97, アダクト: [M+NH4]+, [M+IsoProp+H]+, 共有数（同様のピークを含むサンプル数）: 1

DB検索結果: TPU 0037-A

DBごとのヒット数: ALL 1 KN 1

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
C46H72O10N4	840.52484	0.732	TPU 0037-A	KNApSAcK: C00015098

Level: 2, プリカーサーm/z: 858.55920

Splash: splash10-0159-0000090000-33e5d40455b102e0b1d3

m/z	Int.	NL	Rel.Int.
565.39	21637	293	1000
533.33	15837	325	731
566.41	5702	292	263
534.38	4741	324	219
535.46	2631	323	121
773.49	1963	85	90
597.40	1730	261	79
695.62	1500	163	69
629.45	1454	229	67
774.56	1251	84	57

Level: 3, プリカーサーm/z: 565.40350

Splash: splash10-001i-0001920000-ecaa8e240614b7520db8

m/z	Int.	NL	Rel.Int.
481.42	1720	84	1000
409.37	464	156	269
535.45	434	30	252
533.40	295	32	171
482.40	255	83	148
313.18	209	252	121
403.35	187	162	108
240.97	157	324	91
451.15	128	114	74
423.25	122	142	70
347.39	117	218	67
465.40	102	100	59
369.18	96	196	55

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Flavone]-A(2OH, 1(C-Glu), 1(C-Xylosyl))-B(1OH)	Flavone	Vicenin 1
[Flavone]-A(2OH, 1(C-Glu), 1(C-Arabinosyl))-B(1OH)	Flavone	Schaftoside
[Flavone]-A(2OH, 1(C-Galactosyl), 1(C-Xylosyl))-B(1OH)	Flavone	Isocorymboside
[Flavone]-A(2OH, 1(C-Arabinosyl), 1(C-Galactosyl))-B(1OH)	Flavone	Neocorymboside
[Flavone]-A(2OH, 1(C-Galactosyl), 1(C-Xylosyl))-B(1OH)	Flavone	6-C-Xylopyranosyl-8-C-galactopyranosylapigenin
[Flavone]-A(2OH, 1(C-Galactosyl), 1(C-Xylosyl))-B(1OH)	Flavone	6-C-Galactopyranosyl-8-C-xylopyranosylapigenin
[Flavone]-A(2OH, 1(C-Glu), 1(C-Xylosyl))-B(1OH)	Flavone	Vicenin 3
[Flavone]-A(2OH, 1(C-Glu), 1(C-Arabinosyl))-B(1OH)	Flavone	Isoschaftoside
[Flavone]-A(2OH, 1(C-Glu), 1(C-Arabinosyl))-B(1OH)	Flavone	Neoschaftoside
[Flavone]-A(2OH, 1(C-Glu), 1(C-Arabinosyl))-B(1OH)	Flavone	Neoisoschaftoside
[Flavone]-A(2OH, 1(C-Glu), 1(C-Apiofuranosyl))-B(1OH)	Flavone	6-C-beta-D-Glucopyranosyl-8-C-beta-D-apiofuranosylapigenin
[Flavone]-A(2OH, 1(C-Arabinosyl), 1(C-Galactosyl))-B(1OH)	Flavone	Corymboside

Level: 3, プリカーサーm/z: 533.34338

Splash: splash10-00di-0019300000-48422858b2e380acce4d

Symbolized Name	MSMS-Category	MSMS-Aglycone
[2'-Hydroxychalcone]-A(2OH, 1(1(O-Feruloyl)-(E)-4-hydroxyprenyl))-B(2OH)	2'-Hydroxychalcone	Isogemichalcone C
[2'-Hydroxychalcone]-A(2OH, 1(1(O-Feruloyl)-(Z)-4-hydroxyprenyl))-B(2OH)	2'-Hydroxychalcone	Gemichalcone C
[2'-Hydroxychalcone]-A(2OH, 1([2,3:@@]-(6,6-Dimethylpyrano)), 1(3-Acetyl-2,4,6-trihydroxy-5-methylbenzyl))-B(1OH)	2'-Hydroxychalcone	4-Hydroxyrottlerin
[Flavone]-A(2OH, 1(2(O-Acetyl)-C-Glu))-B(2OH)	Flavone	Isoorientin 2'',6''-O-diacetate
[Flavone]-A(1OH, 1OMe, 1(1(O-Acetyl)-C-Glu))-B(2OMe)	Flavone	6''-O-Acetylisoorientin 7,3',4'-trimethyl ether
[Flavone]-A(2OH, 1(2(O-Acetyl)-C-Glu))-B(2OH)	Flavone	Orientin 2'',6''-O-diacetate
[Flavone]-A(2OH, 1(1(O-<2-Methylbutyroyl>)-C-Glu))-B(2OH)	Flavone	Orientin 2''-O-(2'''-methylbutyrate)

m/z	Int.	NL	Rel.Int.
371.19	286	162	1000
315.28	98	218	343
431.44	90	102	315
241.09	81	292	283
313.35	64	220	222
443.69	50	90	174
355.15	40	178	138
473.44	30	60	103
325.65	28	208	98
202.75	24	331	82
413.34	23	120	81
515.22	22	18	75
533.35	20	-0	68
372.25	18	161	63

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	FS2	FS3	共有数
	97.48	863.51560	4.9563	1.84	[M+Na]+	TPU 0037-A	ALL 1 KN 1	MS2 MS3 x 2			1
12243	97.47	858.55929	0.0000	1.97	[M+NH4]+, [M+IsoProp+H]+	TPU 0037-A	ALL 1 KN 1	MS2 MS3 x 2			1