Processed databases
Atom-Mass pairs
Outputs for Hippuric acid; LC-ESI-QQ; MS2; CE:50 V; [M-H]-
Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO001095
Synonyms: Hippurate, N-Benzoylglycine, Benzoylaminoacetic acid, Hippuric acid
Total mass: 179.1723
Formula: H9 C9 O3 N1
Experimental information
MS type: MS2
Instrument: API3000, Applied Biosystems
Instrument type: LC-ESI-QQ
Ionization mode: NEGATIVE
CAMP general report:
Acceptable mass threshold: 2.0158Out of range queried mass peaks:
Replicated queried mass peaks: 46.2, 60.3, 104.3,
Processing time: 0:00:01.593395
Results for the quried mass "42.0"
| Formula | Mass differences | Num. used protons | Num. required extra protons | Atom names |
| C2N1 | 0.060 | 4 | 2 | C6,C9,N10 |
| C2N1 | 0.060 | 4 | 2 | C6,C8,N10 |
| C1O1N1 | 0.017 | 0 | 0 | C9,N10,O13 |
| C1O2 | 0.006 | 2 | 1 | C8,O11,O12 |
| C2O1 | 0.037 | 2 | 0 | C6,C8,O11 |
| C2O1 | 0.037 | 2 | 0 | C6,C8,O12 |
| C2O1 | 0.037 | 2 | 1 | C7,C9,O13 |