Related entries (identical compound): KO001096 KO001097 KO001098 KO001099 KO001100 JP011626

Submission id: KO001097

Outputs for 3-(4-Hydroxyphenyl)propionic acid; LC-ESI-QQ; MS2; CE:20 V; [M-H]-

Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO001097
Synonyms: 3-(4-Hydroxyphenyl)propionate, Phloretic acid, Phloretate, 3-(4-Hydroxyphenyl)propionic acid
Total mass: 166.1735
Formula: H10 C9 O3

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: 98.9, 150.2,
Processing time: 0:00:02.627591
Queried mass list: ['34.900', '44.700', '58.800', '72.800', '78.900', '93.100', '96.900', '119.000', '121.200', '148.900', '165.300']

Queried mass	Num. matched formulas	Num. matched fragments
34.9 (link to fragments)	1	10
44.7 (link to fragments)	2	2
58.8 (link to fragments)	3	17
72.8 (link to fragments)	2	14
78.9 (link to fragments)	3	14
93.1 (link to fragments)	2	3
96.9 (link to fragments)	1	2
119.0 (link to fragments)	2	3
121.2 (link to fragments)	2	3
148.9 (link to fragments)	2	7
165.3 (link to fragments)	1	1