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Atom-Mass pairs
Related entries (identical compound): KO001421 KO001420 PR100874 JP003539 JP011335 KO001417 KO001418 KO001419 JP011565
Submission id: KO001421

Outputs for (S)-Mandelic acid; LC-ESI-QQ; MS2; CE:50 V; [M-H]-


Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO001421
Synonyms: (S)-Mandelate, (S)-Mandelic acid, (S)-2-Hydroxy-2-phenylacetic acid, (S)-2-Hydroxy-2-phenylacetate
Total mass: 152.147
Formula: H8 C8 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:
Processing time: 0:00:00.749709
Queried mass list: ['45.500', '59.100', '92.800']



Queried massNum. matched formulasNum. matched fragments
45.5 (link to fragments) 1 1
59.1 (link to fragments) 2 16
92.8 No match found! No match found!


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