MassBank Record: JP002032



 2-AMINOPYRIMIDINE 1-OXIDE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP002032
RECORD_TITLE: 2-AMINOPYRIMIDINE 1-OXIDE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SASAKI S, TOYOHASHI UNIV. OF TECH.
LICENSE: CC BY-NC-SA

CH$NAME: 2-AMINOPYRIMIDINE 1-OXIDE CH$COMPOUND_CLASS: N/A CH$FORMULA: C4H5N3O CH$EXACT_MASS: 111.04326 CH$SMILES: Nc(n1)[n+1]([O-1])ccc1 CH$IUPAC: InChI=1S/C4H5N3O/c5-4-6-2-1-3-7(4)8/h1-3H,(H2,5,6)
AC$INSTRUMENT: MS-902 AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-03di-6900000000-e091f19d3de9fbbe7ab4 PK$NUM_PEAK: 23 PK$PEAK: m/z int. rel.int. 44 4.1 41 45 1.6 16 47.5 1.3 13 51 0.19 2 52 6 60 53 7.5 75 54 4.4 44 55 0.14 1 55.5 1.3 13 57 1.6 16 66 3.3 33 67 1.1 11 68 17.6 176 69 2.8 28 70 14.2 142 77 0.11 1 81 1.7 17 84 1.7 17 94 2.2 22 95 2.48 25 96 1.7 17 111 99.99 999 112 6.3 63 //