ピーク情報

シロイヌナズナ　地上部

pos

Peak #11519 MN MID: SE200_S1_M90

m/z: 824.51737, RT: 94.34, 強度: 1579530, ログ強度: 2.49, アダクト: [M+CH5N+H]+, [M+NH4]+, [M+CH3OH-2(H2O)+NH4]+, [M-H2O+NH4]+, 共有数（同様のピークを含むサンプル数）: 1

DB検索結果: (2 names) Stichoposide;Sanguisorbin E

DBごとのヒット数: ALL 2 HM 2

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
C43H68O13	792.46599	2.406	Stichoposide	HMDB: HMDB0258497
C43H68O13	792.46599	2.406	Sanguisorbin E	HMDB: HMDB0040523

MSnスペクトル情報

Level: 2, プリカーサーm/z: 824.51514

Splash: splash10-001i-0000090000-a26c4a9490da84bb3c6b

m/z	Int.	NL	Rel.Int.
533.35	127863	291	1000
534.34	14605	290	114

Level: 3, プリカーサーm/z: 533.34772

Splash: splash10-00xr-0019000000-9dbd146d60d999819c18

m/z	Int.	NL	Rel.Int.
371.31	2562	162	1000
315.25	1557	218	607
241.05	392	292	152
243.06	381	290	148
389.40	243	144	95
355.31	196	178	76
429.38	181	104	70
459.36	168	74	65
383.32	161	150	62
313.18	153	220	59

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)

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
	94.35	845.44915	20.9318	1.77	[M+CH3OH-H2O+K]+, [M+K]+, [M+CH3OH+H]+	PA(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))	ALL 1 LM 1	MS2 MS3 x 2	1
	94.34	829.47375	4.9564	2.26	[M+CH3OH-2(H2O)+Na]+, [M+CH3OH+Na]+, [M+Na]+, [M-H2O+Na]+	(22 names) Thalictoside I; Goyaglycoside g; PA(22:5(4Z,7Z,10Z,13Z,16Z)/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4)); PA(22:5(4Z,7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13E,15E,19Z)-OH(17)); PA(22:5(4Z,7Z,10Z,13Z,19Z)-O(16,17)/22:5(4Z,...	ALL 22 KN 1 HM 21	MS2 MS3	1
11519	94.34	824.51737	0.0000	2.49	[M+CH5N+H]+, [M+NH4]+, [M+CH3OH-2(H2O)+NH4]+, [M-H2O+NH4]+	(2 names) Stichoposide; Sanguisorbin E	ALL 2 HM 2	MS2 MS3	1

ピーク情報

DB検索結果

MSnスペクトル情報

FlavonoidSearch結果

FlavonoidSearch結果

関連ピーク情報