DL-beta-Hydroxybutyric acid; LC-ESI-IT; MS2; m/z: 105.1; [M+H]+

Computational Annotation of MS Peaks (CAMP)

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Submission id: MT000033

Outputs for DL-beta-Hydroxybutyric acid; LC-ESI-IT; MS2; m/z: 105.1; [M+H]+

Database: Metabolon Inc.
Entry ID: MT000033
Synonyms: DL-beta-Hydroxybutyric acid, 3-hydroxybutyrate
Total mass: 104.1042
Formula: H8 C4 O3

Experimental information

MS type: MS2
Instrument: LTQ XL, Thermo Finnigan
Instrument type: LC-ESI-IT
Ionization: ESI
Ionization mode: POSITIVE

CAMP general report:

Acceptable mass threshold: 2.0158
Out of range queried mass peaks:
Replicated queried mass peaks: 73.8, 77.2, 87.1, 88.0, 91.1, 107.1,
Processing time: 0:00:01.629990

Results for the quried mass "55.3"

Formula	Mass differences	Num. used protons	Num. required extra protons	Atom names
C2O2	0.288	1	0	C2,C4,O6,O7
C3O1	0.245	3	0	C1,C2,C3,O5
C4	0.202	7	1	C1,C2,C3,C4