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

Submission id: KO000587

Outputs for Dihydrocaffeic acid; LC-ESI-QQ; MS2; CE:40 V; [M-H]-

Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO000587
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: 91.0, 107.5, 108.2, 121.0, 135.3,
Processing time: 0:00:01.855330
Queried mass list: ['41.100', '45.200', '52.900', '57.000', '59.200', '67.200', '78.400', '81.200', '90.200', '93.000', '96.700', '106.800', '109.400', '116.900', '119.000', '122.300', '134.400']

Queried mass	Num. matched formulas	Num. matched fragments
41.1 (link to fragments)	2	8
45.2 (link to fragments)	1	1
52.9 (link to fragments)	2	15
57.0 (link to fragments)	2	5
59.2 (link to fragments)	2	17
67.2 (link to fragments)	3	16
78.4 (link to fragments)	3	31
81.2 (link to fragments)	2	16
90.2 (link to fragments)	3	33
93.0 (link to fragments)	3	26
96.7 (link to fragments)	3	13
106.8 (link to fragments)	1	3
109.4 (link to fragments)	1	3
116.9 (link to fragments)	1	2
119.0 (link to fragments)	2	3
122.3 (link to fragments)	2	3
134.4 (link to fragments)	2	3