Processed databases
Atom-Mass pairs
Outputs for Phosphonoacetate; LC-ESI-QQ; MS2; CE:40 V; [M+H]+
Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO003846
Synonyms: Phosphonoacetate, Phosphonoacetic acid
Total mass: 140.0317
Formula: P1 C2 O5 H5
Structure file (with ALATIS unique atom labels)
Experimental information
MS type: MS2Instrument: API3000, Applied Biosystems
Instrument type: LC-ESI-QQ
Ionization mode: POSITIVE
CAMP general report:
Acceptable mass threshold: 2.0158Out of range queried mass peaks:
Replicated queried mass peaks: 79.0, 80.1, 124.1,
Processing time: 0:00:01.490822
Queried mass list: ['44.100', '53.000', '59.200', '78.100', '80.800', '96.400', '123.200']
| Queried mass | Num. matched formulas | Num. matched fragments |
| 44.1 (link to fragments) | 3 | 3 |
| 53.0 (link to fragments) | 1 | 1 |
| 59.2 (link to fragments) | 2 | 4 |
| 78.1 (link to fragments) | 1 | 1 |
| 80.8 (link to fragments) | 1 | 1 |
| 96.4 (link to fragments) | 1 | 1 |
| 123.2 (link to fragments) | 1 | 5 |