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

Submission id: KO000586

Outputs for Dihydrocaffeic acid; LC-ESI-QQ; MS2; CE:30 V; [M-H]-

Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO000586
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: 80.9, 91.3, 107.8, 109.3, 118.9, 121.9, 137.0,
Processing time: 0:00:02.375628
Queried mass list: ['41.100', '45.200', '59.000', '70.700', '79.000', '89.500', '93.000', '95.200', '107.400', '118.000', '121.100', '135.300', '166.000', '181.200']

Queried mass	Num. matched formulas	Num. matched fragments
41.1 (link to fragments)	2	8
45.2 (link to fragments)	1	1
59.0 (link to fragments)	3	18
70.7 (link to fragments)	3	17
79.0 (link to fragments)	3	31
89.5 (link to fragments)	2	30
93.0 (link to fragments)	3	26
95.2 (link to fragments)	3	21
107.4 (link to fragments)	1	3
118.0 (link to fragments)	1	2
121.1 (link to fragments)	2	3
135.3 (link to fragments)	2	3
166.0 (link to fragments)	2	7
181.2 (link to fragments)	1	1