MassBank Record: JP002040



 5-ACETYL-3,4-DIHYDRO-6-HYDROXYPYRIMIDIN-4-ONE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP002040
RECORD_TITLE: 5-ACETYL-3,4-DIHYDRO-6-HYDROXYPYRIMIDIN-4-ONE; 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$NAME: 5-ACETYL-3,4-DIHYDRO-6-HYDROXYPYRIMIDIN-4-ONE CH$COMPOUND_CLASS: N/A CH$FORMULA: C6H6N2O3 CH$EXACT_MASS: 154.03784 CH$SMILES: CC(=O)C(=C(O)1)C(=O)NC=N1 CH$IUPAC: InChI=1S/C6H6N2O3/c1-3(9)4-5(10)7-2-8-6(4)11/h2H,1H3,(H2,7,8,10,11)
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$SPLASH: splash10-000i-4900000000-77f464783e8c7108a029 PK$NUM_PEAK: 35 PK$PEAK: m/z int. rel.int. 36 4.3 43 38 1.3 13 39 1.9 19 40 0.19 2 41 2.8 28 42 4 40 43 18.1 181 44 1.61 16 45 1 10 53 1.2 12 55 1.9 19 56 0.23 2 57 2.3 23 66 1.3 13 67 2 20 68 0.37 4 69 14.3 143 70 1.3 13 71 26.9 269 83 0.29 3 84 5.9 59 85 1.6 16 92 2.2 22 111 0.13 1 112 8.9 89 125 1.9 19 126 1.3 13 137 0.19 2 139 99.99 999 140 5.7 57 141 1 10 151 0.1 1 153 7.3 73 154 48.9 489 155 5.5 55 //