3-Hydroxy-3-methylglutaric acid; LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M+H]+

Computational Annotation of MS Peaks (CAMP)

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Submission id: PR100380

Outputs for 3-Hydroxy-3-methylglutaric acid; LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M+H]+

Database: Plant Science Center, RIKEN
Entry ID: PR100380
Synonyms: 3-Hydroxy-3-methylglutarate, HMG, HMGA, 3-Hydroxy-3-methylglutaric acid, beta-Hydroxy-beta-methylglutaric acid, Dicrotalic acid, 3-Hydroxy-3-methylpentanedioic acid, Meglutol, Lipoglutaren, Medroglutaric acid, alpha-Keto-beta-oxy-beta-methylvalerate
Total mass: 162.1402
Formula: H10 C6 O5

Experimental information

MS type: MS2
Instrument: UPLC Q-Tof Premier, Waters
Instrument type: LC-ESI-QTOF
Ionization: ESI
Ionization mode: POSITIVE

CAMP general report:

Acceptable mass threshold: 2.0158
Out of range queried mass peaks:
Replicated queried mass peaks:
Processing time: 0:00:01.838634

Results for the quried mass "99.0447"

Formula	Mass differences	Num. used protons	Num. required extra protons	Atom names
C4O3	0.020	3	0	C1,C3,C5,C6,O9,O10,O11
C4O3	0.020	3	0	C1,C2,C4,C6,O7,O8,O11