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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: KO003603

Outputs for (-)-Nicotine; LC-ESI-QQ; MS2; CE:20 V; [M+H]+


Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO003603
Synonyms: Nicotine, (S)-3-(1-methylpyrrolidin-2-yl)pyridine, (-)-Nicotine
Total mass: 162.231
Formula: H14 C10 N2

Structure file (with ALATIS unique atom labels)

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: 40.6, 46.0, 71.8, 79.2, 81.0, 81.9, 89.1, 92.1, 95.9, 100.0, 103.8, 106.1, 110.0, 114.4, 115.3, 118.3, 119.2, 132.1, 163.3,
Processing time: 0:00:02.871362
Queried mass list: ['38.900', '44.100', '55.000', '57.900', '70.100', '74.100', '78.000', '80.200', '84.200', '87.800', '91.200', '94.100', '99.000', '102.900', '105.500', '108.200', '113.600', '117.200', '120.200', '128.000', '130.100', '134.200', '144.000', '146.300', '161.300']



Queried massNum. matched formulasNum. matched fragments
38.9 (link to fragments) 2 15
44.1 No match found! No match found!
55.0 (link to fragments) 2 10
57.9 (link to fragments) 1 1
70.1 (link to fragments) 2 8
74.1 (link to fragments) 3 13
78.0 (link to fragments) 3 13
80.2 (link to fragments) 1 1
84.2 (link to fragments) 2 3
87.8 (link to fragments) 1 2
91.2 (link to fragments) 1 2
94.1 (link to fragments) 1 1
99.0 (link to fragments) 1 3
102.9 (link to fragments) 1 3
105.5 (link to fragments) 1 3
108.2 (link to fragments) 2 5
113.6 (link to fragments) 2 5
117.2 (link to fragments) 2 5
120.2 (link to fragments) 3 8
128.0 (link to fragments) 2 7
130.1 (link to fragments) 2 7
134.2 (link to fragments) 4 16
144.0 (link to fragments) 2 9
146.3 (link to fragments) 3 10
161.3 (link to fragments) 1 1


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