GABA; GC-EI-TOF; MS; 3 TMS; BP:174

Computational Annotation of MS Peaks (CAMP)

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Atom-Mass pairs

Submission id: KZ000099

Outputs for GABA; GC-EI-TOF; MS; 3 TMS; BP:174

Database: Kazusa DNA Research Institute
Entry ID: KZ000099
Synonyms: 4-Aminobutyric acid, GABA
Total mass: 103.1194
Formula: H9 C4 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: 110.0,113.0,116.0,119.0,124.0,127.0,130.0,133.0,139.0,142.0,146.0,154.0,157.0,160.0,168.0,171.0,174.0,184.0,187.0,198.0,203.0,212.0,216.0,219.0,227.0,230.0,246.0,288.0,302.0,
Replicated queried mass peaks: 83.0, 84.0, 86.0, 92.0, 93.0, 95.0, 96.0, 98.0, 99.0, 105.0, 111.0, 112.0, 114.0, 115.0, 117.0, 125.0, 126.0, 128.0, 129.0, 131.0, 132.0, 140.0, 141.0, 143.0, 147.0, 155.0, 156.0, 158.0, 159.0, 161.0, 169.0, 170.0, 172.0, 173.0, 185.0, 186.0, 188.0, 204.0, 205.0, 213.0, 214.0, 228.0, 231.0, 303.0, 304.0,
Processing time: 0:00:00.725811

Results for the quried mass "82.0"

Formula	Mass differences	Num. used protons	Num. required extra protons	Atom names
C4O1N1	0.081	4	0	C1,C2,C3,C4,N5,O7
C4O1N1	0.081	4	0	C1,C2,C3,C4,N5,O6
C4O2	0.057	2	0	C1,C2,C3,C4,O6,O7