ピーク情報

イヌカタヒバ

pos

Peak #10514 MN MID: SE205_S02_M90

m/z: 545.38440, RT: 92.51, 強度: 18318, ログ強度: 0.74, アダクト: [M+CH3OH-H2O+H]+, 共有数（同様のピークを含むサンプル数）: 2

DB検索結果: (9 names) Phyllofenone C;(+)-Phyllofenone C;Holstinone A;(-)-Holstinone A;Rubianol b;Cordianol F;(+)-Cordianol F;Acinospesigenin A;Guavanoic acid

DBごとのヒット数: ALL 6 KN 6

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
C32H50O6	530.36074	1.383	Phyllofenone C	KNApSAcK: C00046855
C32H50O6	530.36074	1.383	(22E,24R)-25-hydroxy-3,3-dimethoxy-11alpha-acetoxyergosta-7,22-diene-6-one	LipidMAPS: LMST01031341
C32H50O6	530.36074	1.383	Holstinone A	KNApSAcK: C00039378
C32H50O6	530.36074	1.383	7beta-acetoxy-3beta,24S-dihydroxy-9beta,19-cyclolanost-25-en-28-oic acid	LipidMAPS: LMST01100056
C32H50O6	530.36074	1.383	Rubianol b	KNApSAcK: C00031235
C32H50O6	530.36074	1.383	Cordianol F	KNApSAcK: C00044654
C32H50O6	530.36074	1.383	Acinospesigenin A	KNApSAcK: C00044493 LipidMAPS: LMPR0106160001
C32H50O6	530.36074	1.383	Guavanoic acid	KNApSAcK: C00037224
C32H50O6	530.36074	1.383	7beta-acetoxy,3beta,25-dihydroxy-9beta,19-cyclo-lanost-23E-en-28-oic acid	LipidMAPS: LMST01100055

MSnスペクトル情報

Level: 2, プリカーサーm/z: 545.38312

Splash: splash10-004i-0000290000-fd7ab259e701631d1235

m/z	Int.	NL	Rel.Int.
527.50	15895	18	1000
471.41	1651	74	103
453.36	1398	92	87
435.39	1379	110	86
509.42	872	36	54

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.000	[2'-Hydroxychalcone]-A(2OH, 1Geranyl)-B(2OH, 1Geranyl)	2'-Hydroxychalcone	Prorepensin

Level: 3, プリカーサーm/z: 527.50250

Splash: splash10-0udr-0014910000-25e19dd9d493826f005d

m/z	Int.	NL	Rel.Int.
435.51	1402	92	1000
471.64	932	56	664
301.17	881	226	628
509.46	803	18	572
453.49	698	74	497
491.35	495	36	353
417.19	370	110	264
351.48	321	176	228
401.39	261	126	186
361.45	224	166	159
473.61	206	54	147
309.24	206	218	146
243.68	203	284	144
327.04	201	200	143
221.02	185	306	131
299.42	179	228	127
355.26	178	172	126
235.24	173	292	123
455.55	168	72	119
359.23	162	168	115

Symbolized Name	MSMS-Category	MSMS-Aglycone
[2'-Hydroxychalcone]-A(2OH, 1([3,2:@@]-(5-oxo-11-Hydroxy-11-styryl-4,10-dioxa-bicyclo[7.3.1]-2-trideceno)))-B(none)	2'-Hydroxychalcone	Kurzichalcolactone
[Flavanone]-A(1OH, 1([3,2:@@]-(5-oxo-11-Hydroxy-11-styryl-4,10-dioxa-bicyclo[7.3.1]-2-trideceno)))-B(none)	Flavanone	Kurziflavolactone A
[Flavanone]-A(1OH, 1([3,2:@@]-(5-oxo-11-Hydroxy-11-styryl-4,10-dioxa-bicyclo[7.3.1]-2-trideceno)))-B(none)	Flavanone	Kurziflavolactone C
[Dihydroflavonol]-A(2OH, 1(3-Hydroxy-3-methylbutyl), 1Lavandulyl)-B(2OH)	Dihydroflavonol	Kosamol A
[Flavan 3-ol]-A(2OH, 1(2,4,6-Trihydroxy-3-isobutyryl-5-methylbenzyl))-B(2OH)	Flavan 3-ol	Pilosanol B
[Flavan 3-ol]-A(2OH, 1(3-Butyryl-2,4,6-trihydroxy-5-methylbenzyl))-B(2OH)	Flavan 3-ol	Pilosanol C

Level: 3, プリカーサーm/z: 471.40515

Splash: splash10-0udi-0001900000-f0dcf0e703f44275a8e0

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.
453.37	379	18	1000
435.48	152	36	401
301.35	79	170	207
417.25	48	54	127
299.34	33	172	87
329.38	24	142	63
287.42	23	184	60
323.39	21	148	54