Processed databases
Atom-Mass pairs
Outputs for (-)-Nicotine; LC-ESI-QQ; MS2; CE:50 V; [M+H]+
Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO003606
Synonyms: Nicotine, (S)-3-(1-methylpyrrolidin-2-yl)pyridine, (-)-Nicotine
Total mass: 162.231
Formula: H14 C10 N2
Experimental information
MS type: MS2
Instrument: 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: 41.1, 42.9, 52.3, 54.2, 57.2, 64.3, 65.1, 67.1, 69.3, 70.0, 78.1, 80.0, 81.3, 90.1, 91.1, 93.2, 95.0, 102.1, 104.1, 105.0, 116.5, 118.2, 119.2, 131.0, 131.9,
Processing time: 0:00:02.688994
Results for the quried mass "117.2"
| Formula | Mass differences | Num. used protons | Num. required extra protons | Atom names |
| C8N1 | 0.052 | 7 | 0 | C1,C3,C4,C5,C7,C8,C9,C10,N12 |
| C8N1 | 0.052 | 7 | 0 | C1,C2,C3,C4,C5,C7,C9,C10,N12 |
| C8N1 | 0.052 | 7 | 0 | C2,C3,C4,C5,C6,C8,C9,C10,N11 |
| C7N2 | 0.072 | 5 | 0 | C1,C3,C5,C7,C8,C9,C10,N11,N12 |
| C7N2 | 0.072 | 5 | 0 | C1,C2,C4,C6,C8,C9,C10,N11,N12 |