ピーク情報

（かんきつ類）グレープフルーツ白肉種砂じょう生

pos

Peak #617 MN MID: SE118_S070621_M90

m/z: 160.09608, RT: 12.10, 強度: 10074, ログ強度: 0.63, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 10

DB検索結果: (16 names) Valerylglycine;Turicine;Methyl 5-(hydroxymethyl)pyrrolidine-3-carboxylate;2-Methylerythritol;Calystegine A6;3-Dehydrocarnitine;2alpha,3beta,4alpha-Trihydroxynortropane;Isovalerylglycine;5-Acetamidoval...

DBごとのヒット数: ALL 16 KG 5 KN 7 HM 4

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
C7H13O3N	159.08954	-4.636	Valerylglycine	HMDB: HMDB0000927
C7H13O3N	159.08954	-4.636	(-)-Betonicine	HMDB: HMDB0029230, HMDB0029409, HMDB0029412 KEGG: C08269, C21513 KNApSAcK: C00001345, C00055249
C7H13O3N	159.08954	-4.636	Methyl 5-(hydroxymethyl)pyrrolidine-3-carboxylate	HMDB: HMDB0061678
C7H13O3N	159.08954	-4.636	2-Methylerythritol	HMDB: HMDB0000339 KNApSAcK: C00052127
C7H13O3N	159.08954	-4.636	Calystegine A6	HMDB: HMDB0031345 KNApSAcK: C00036864
C7H13O3N	159.08954	-4.636	3-Dehydrocarnitine	HMDB: HMDB0012154 KEGG: [1]C02636
C7H13O3N	159.08954	-4.636	2alpha,3beta,4alpha-Trihydroxynortropane	KNApSAcK: C00032627
C7H13O3N	159.08954	-4.636	Isovalerylglycine	HMDB: HMDB0000678 KNApSAcK: C00052329
C7H13O3N	159.08954	-4.636	Medicanine	HMDB: HMDB0038625 KNApSAcK: C00053465
C7H13O3N	159.08954	-4.636	5-Acetamidopentanoate	HMDB: HMDB0012175 KEGG: C03087 LipidMAPS: LMFA01030987
C7H13O3N	159.08954	-4.636	Calystegine A7	HMDB: HMDB0036384 KNApSAcK: C00036865
C7H13O3N	159.08954	-4.636	N-Acetylvaline	HMDB: HMDB0011757
C7H13O3N	159.08954	-4.636	2-Pivalamidoacetic acid	HMDB: HMDB0245297
C7H13O3N	159.08954	-4.636	Calystegine A5	KNApSAcK: C00036863
C7H13O3N	159.08954	-4.636	3-Hydroxystachydrine	HMDB: HMDB0242121 KEGG: C10151 KNApSAcK: C00002045
C7H13O3N	159.08954	-4.636	Calystegin A3	HMDB: HMDB0038593 KEGG: C10850 KNApSAcK: C00002282

MSnスペクトル情報

Level: 2, プリカーサーm/z: 160.09651

Splash: splash10-000i-9100000000-e98847add1473ccc1227

m/z	Int.	NL	Rel.Int.
87.94	49361	72	1000
101.92	3560	58	72
114.04	2745	46	55

Level: 3, プリカーサーm/z: 87.93608

Splash: splash10-00di-9000000000-4deb9f1691fea0623d4a

m/z	Int.	NL	Rel.Int.
70.14	373	18	1000

Level: 3, プリカーサーm/z: 101.91988

Splash: splash10-0f6x-9500000000-a863edc11791873e04d1

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.
92.26	329	10	1000
153.77	194	-52	588