Related entries (identical compound): KO000587 KO000586 KO000585 KO000584 KO000588

Submission id: KO000588

Outputs for Dihydrocaffeic acid; LC-ESI-QQ; MS2; CE:50 V; [M-H]-

Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO000588
Synonyms: Dihydrocaffeate, Dihydrocaffeic acid, 3,4-Dihydroxyphenylpropionic acid, Dihydrocaffeic acid
Total mass: 182.1729
Formula: H10 C9 O4

Structure file (with ALATIS unique atom labels)

Experimental information

MS type: MS2
Instrument: API3000, Applied Biosystems
Instrument type: LC-ESI-QQ
Ionization mode: NEGATIVE

CAMP general report:

Acceptable mass threshold: 2.0158
Out of range queried mass peaks:
Replicated queried mass peaks: 91.4, 109.0, 118.9, 135.2,
Processing time: 0:00:01.854948
Queried mass list: ['41.100', '45.200', '52.800', '59.200', '65.300', '78.700', '80.800', '89.900', '93.300', '108.000', '117.000', '121.300', '133.600']

Queried mass	Num. matched formulas	Num. matched fragments
41.1 (link to fragments)	2	8
45.2 (link to fragments)	1	1
52.8 (link to fragments)	2	15
59.2 (link to fragments)	2	17
65.3 (link to fragments)	2	19
78.7 (link to fragments)	3	31
80.8 (link to fragments)	3	23
89.9 (link to fragments)	2	30
93.3 (link to fragments)	2	23
108.0 (link to fragments)	1	3
117.0 (link to fragments)	1	2
121.3 (link to fragments)	2	3
133.6 (link to fragments)	2	3