NMRFAM Logo Computational Annotation of MS Peaks (CAMP)
Home
Processed databases
Atom-Mass pairs
Related entries (identical compound): JP009715 JP003799 PR100077 JP010826 KO003605 KO003604 KO003606 KO003603 KO003602 EQ300803 EQ300802 EQ300801 EQ300806 EQ300805 EQ300804 JP003492 BML81800 BML81802
Submission id: EQ300803

Outputs for Nicotine; LC-ESI-QFT; MS2; CE: 45; R=35000; [M+H]+


Database: Department of Environmental Chemistry, Eawag
Entry ID: EQ300803
Synonyms: Nicotine, 3-[(2S)-1-methylpyrrolidin-2-yl]pyridine, 3-[(2S)-1-methyl-2-pyrrolidinyl]pyridine
Total mass: 162.231
Formula: H14 C10 N2

Structure file (with ALATIS unique atom labels)

Experimental information

MS type: MS2
Instrument: Q Exactive Orbitrap Thermo Scientific
Instrument type: LC-ESI-QFT
Ionization: ESI
Ionization mode: POSITIVE

CAMP general report:

Acceptable mass threshold: 2.0158
Out of range queried mass peaks:
Replicated queried mass peaks: 78.0336, 94.065, 106.065, 117.0571, 131.0728, 132.0806,
Processing time: 0:00:01.894235
Queried mass list: ['70.065', '77.038', '80.049', '84.081', '92.049', '105.070', '115.054', '120.081', '130.065', '134.096', '163.123']



Queried massNum. matched formulasNum. matched fragments
70.0651 (link to fragments) 2 8
77.0382 (link to fragments) 3 13
80.0494 (link to fragments) 1 2
84.0807 (link to fragments) 2 3
92.0494 (link to fragments) 1 2
105.0698 (link to fragments) 1 3
115.0542 (link to fragments) 2 5
120.0807 (link to fragments) 2 5
130.0651 (link to fragments) 2 7
134.0965 (link to fragments) 4 16
163.1227 (link to fragments) 1 1


Flag Counter