MassBank Record: JP001416



 2,3-DICHLORO-5,6-DICYANO-P-BENZOQUINONE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP001416
RECORD_TITLE: 2,3-DICHLORO-5,6-DICYANO-P-BENZOQUINONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HASHIMOTO K, KYOTO COLLEGE OF PHARMACY
LICENSE: CC BY-NC-SA

CH$NAME: 2,3-DICHLORO-5,6-DICYANO-P-BENZOQUINONE CH$COMPOUND_CLASS: N/A CH$FORMULA: C8Cl2N2O2 CH$EXACT_MASS: 225.93368 CH$SMILES: N#Cc(c(=O)1)c(C#N)c(=O)c(Cl)c(Cl)1 CH$IUPAC: InChI=1S/C8Cl2N2O2/c9-5-6(10)8(14)4(2-12)3(1-11)7(5)13
AC$INSTRUMENT: HITACHI M-80 AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-004i-1490000000-fc79b76ded251a015a21 PK$NUM_PEAK: 41 PK$PEAK: m/z int. rel.int. 57 1 10 71 1.7 17 76 4.2 42 85 0.18 2 87 16.7 167 89 5.6 56 94 5.3 53 95 0.14 1 96 3.3 33 97 1.7 17 104 4.5 45 111 0.33 3 122 23.2 232 124 14.2 142 126 1.6 16 129 0.3 3 135 4.6 46 136 1 10 137 4.6 46 150 0.41 4 152 1 10 163 7.5 75 165 3 30 170 6.9 69 171 5.6 56 172 46 460 173 4.9 49 174 0.78 8 191 9.4 94 192 2.5 25 193 5.3 53 198 3.77 38 199 3.8 38 200 40.2 402 226 99.99 999 227 1.02 10 228 98.5 985 229 10.5 105 230 33.3 333 231 0.28 3 232 3.5 35 //