Related entries (identical compound): KO001235 KO001232 KO001233 KO001234 KO001231

Submission id: KO001232

Outputs for Isethionic acid; LC-ESI-QQ; MS2; CE:20 V; [M-H]-

Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO001232
Synonyms: Isethionate, 2-Hydroxyethanesulfonic acid, Isethionic acid, 2-Hydroxyethane-1-sulfonic acid, 2-Hydroxyethanesulfonate
Total mass: 126.1314
Formula: H6 C2 S1 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: 80.6, 123.3, 125.0,
Processing time: 0:00:01.498802
Queried mass list: ['64.900', '80.100', '89.000', '95.100', '106.900', '123.100']

Queried mass	Num. matched formulas	Num. matched fragments
64.9 (link to fragments)	2	4
80.1 (link to fragments)	1	1
89.0	No match found!	No match found!
95.1 (link to fragments)	1	1
106.9 (link to fragments)	1	4
123.1 (link to fragments)	1	1