MassBank Record: JP005273



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

ACCESSION: JP005273
RECORD_TITLE: P-CHLOROBENZALDEHYDE; EI-B; MS
DATE: 2016.01.19 (2008.10.21, 2011.05.06)
AUTHORS: YAMAMOTO MDEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV., DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: P-CHLOROBENZALDEHYDE CH$NAME: 4-CHLOROBENZALDEHYDE CH$COMPOUND_CLASS: N/A CH$FORMULA: C7H5ClO CH$EXACT_MASS: 140.00289 CH$SMILES: O=Cc(c1)ccc(Cl)c1 CH$IUPAC: InChI=1S/C7H5ClO/c8-7-3-1-6(5-9)2-4-7/h1-5H CH$LINK: INCHIKEY AVPYQKSLYISFPO-UHFFFAOYSA-N
AC$INSTRUMENT: HITACHI RMU-6M AC$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$SPLASH: splash10-01p6-4900000000-c472a44843eaabe4bc7c PK$NUM_PEAK: 37 PK$PEAK: m/z int. rel.int. 26 1.04 10 27 2.04 20 29 3.49 35 37 4.72 47 37.5 1.57 16 38 6.7 67 39 2.15 22 44 1.22 12 49 3.5 35 50 25.89 259 51 18.48 185 52 4.78 48 55 1.22 12 60 1 10 61 2.27 23 62 1.98 20 63 1.75 18 73 4.2 42 74 14.57 146 75 28.86 289 76 8.57 86 77 17.08 171 78 1.28 13 84 1.57 16 85 3.91 39 86 1 10 87 1.28 13 110 1.1 11 111 55.51 555 112 8.45 85 113 18.36 184 114 2.68 27 139 99.99 999 140 71.02 710 141 37.67 377 142 24.37 244 143 1.52 15 //