ピーク情報

トマト Micro-Tom 花

pos

Peak #1641 MN MID: SE203_S31_M90

m/z: 294.11816, RT: 18.96, 強度: 2732, ログ強度: -0.22, アダクト: [M+ACN+IsoProp+H]+, [M+H]+, 共有数（同様のピークを含むサンプル数）: 3

DB検索結果: (12 names) Diketogulonic acid;2-Dehydro-3-deoxy-D-glucarate;Isocitric acid;D-Glucaro-1,5-lactone;Citric acid;dehydroascorbate (bicyclic form);D-Glucaro-1,4-lactone;Carboxymethyloxysuccinate;(Carboxymethoxy) succ...

DBごとのヒット数: ALL 11 KG 8 HM 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
C6H8O7	192.02700	-0.932	(4R,5S)-4,5,6-Trihydroxy-2,3-dioxohexanoate	HMDB: HMDB0005971, HMDB0006511, HMDB0062803, [-1]HMDB0304040 KEGG: C04575 LipidMAPS: LMFA01060195
C6H8O7	192.02700	-0.932	5-Dehydro-4-deoxy-D-glucarate	KEGG: C00679, C03921, C21091
C6H8O7	192.02700	-0.932	Isocitric acid	HMDB: HMDB0000193, HMDB0001874, HMDB0033717, [-3]HMDB0304324 KEGG: C00311, C04617, C00451 KNApSAcK: C00001188
C6H8O7	192.02700	-0.932	D-Glucaro-1,5-lactone	KEGG: C20890, C20889
C6H8O7	192.02700	-0.932	Citric acid	HMDB: HMDB0000094, [-3f]HMDB0303240, [-3f]HMDB0303409, [f]HMDB0303432, [-3f]HMDB0303461, [-3f]HMDB0303471, [-3f]HMDB0303488, [f]HMDB0303646, [f]HMDB0303723, [f]HMDB0303750, [f]HMDB0303751, [f]HMDB0303752, [f]HMDB0303753 KEGG: C00158, [f]C12649, [-3f]C13249, [f]C13660, [-3f]C06229 KNApSAcK: C00007619
C6H8O7	192.02700	-0.932	dehydroascorbate (bicyclic form)	HMDB: HMDB0304326
C6H8O7	192.02700	-0.932	D-Glucaro-1,4-lactone	HMDB: HMDB0041862 KEGG: C21095, C20896
C6H8O7	192.02700	-0.932	2-carboxy-L-xylonolactone	HMDB: [-1]HMDB0304063
C6H8O7	192.02700	-0.932	Carboxymethyloxysuccinate	KEGG: C03600
C6H8O7	192.02700	-0.932	Sodium ferricitropyrophosphate	HMDB: [-4f]HMDB0303295
C6H8O7	192.02700	-0.932	2,5-Didehydro-D-gluconate	KEGG: C02780 LipidMAPS: LMFA01050471

MSnスペクトル情報

Level: 2, プリカーサーm/z: 294.11746

Splash: splash10-004i-0090000000-52ee2456792e0a520c7b

m/z	Int.	NL	Rel.Int.
276.07	9677	18	1000
222.21	971	72	100

Level: 3, プリカーサーm/z: 276.07397

Splash: splash10-000i-0940000000-d9b5f3014b101b147134

m/z	Int.	NL	Rel.Int.
186.07	272	90	1000
258.07	98	18	359
168.01	63	108	230
137.96	53	138	194
244.00	41	32	151
230.19	31	46	114
248.01	30	28	108
202.07	21	74	78
193.96	21	82	76
113.85	20	162	74
144.12	16	132	58

Level: 3, プリカーサーm/z: 222.20917

Splash: splash10-014i-1910000000-0d82e3873a8010e6e68a

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

m/z	Int.	NL	Rel.Int.
165.03	161	57	1000
122.91	34	99	212
99.98	26	122	160
205.00	20	17	126
194.06	16	28	101
222.30	8	-0	51