Nicotinic acid; GC-EI-TOF; MS; 1 TMS; BP:136

Computational Annotation of MS Peaks (CAMP)

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Submission id: KZ000167

Outputs for Nicotinic acid; GC-EI-TOF; MS; 1 TMS; BP:136

Database: Kazusa DNA Research Institute
Entry ID: KZ000167
Synonyms: Nicotinic acid
Total mass: 123.1092
Formula: H5 C6 O2 N1

Experimental information

MS type: MS
Instrument: Pegasus III TOF-MS system, Leco; GC 6890, Agilent Technologies
Instrument type: GC-EI-TOF
Ionization mode: POSITIVE

CAMP general report:

Acceptable mass threshold: 2.0158
Out of range queried mass peaks: 132.0,135.0,138.0,150.0,154.0,162.0,165.0,174.0,179.0,182.0,194.0,
Replicated queried mass peaks: 83.0, 84.0, 86.0, 91.0, 92.0, 94.0, 95.0, 97.0, 100.0, 105.0, 106.0, 108.0, 109.0, 120.0, 121.0, 134.0, 136.0, 137.0, 151.0, 152.0, 164.0, 180.0, 181.0, 195.0, 196.0,
Processing time: 0:00:00.734149

Results for the quried mass "96.0"

Formula	Mass differences	Num. used protons	Num. required extra protons	Atom names
C5O2	0.084	4	0	C1,C2,C4,C5,C6,O8,O9
C5O2	0.084	4	0	C1,C2,C3,C5,C6,O8,O9
C4O2N1	0.064	2	0	C3,C4,C5,C6,N7,O8,O9
C4O2N1	0.064	2	0	C2,C4,C5,C6,N7,O8,O9