Phosphonoacetate; LC-ESI-QQ; MS2; CE:10 V; [M+H]+

Computational Annotation of MS Peaks (CAMP)

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Submission id: KO003843

Outputs for Phosphonoacetate; LC-ESI-QQ; MS2; CE:10 V; [M+H]+

Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO003843
Synonyms: Phosphonoacetate, Phosphonoacetic acid
Total mass: 140.0317
Formula: P1 C2 O5 H5

Experimental information

MS type: MS2
Instrument: API3000, Applied Biosystems
Instrument type: LC-ESI-QQ
Ionization mode: POSITIVE

CAMP general report:

Acceptable mass threshold: 2.0158
Out of range queried mass peaks:
Replicated queried mass peaks: 51.2, 77.3, 80.8, 83.9, 91.3, 91.9, 99.1, 99.9, 105.3, 124.1,
Processing time: 0:00:01.844600

Results for the quried mass "90.8"

Formula	Mass differences	Num. used protons	Num. required extra protons	Atom names
P1C1O3	0.183	0	0	C1,O5,O6,O7,P8