MassBank Record: JP005270



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

ACCESSION: JP005270
RECORD_TITLE: P-CHLOROANILINE; 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$NAME: P-CHLOROANILINE CH$NAME: 4-CHLOROANILINE CH$COMPOUND_CLASS: N/A CH$FORMULA: C6H6ClN CH$EXACT_MASS: 127.01888 CH$SMILES: Nc(c1)ccc(Cl)c1 CH$IUPAC: InChI=1S/C6H6ClN/c7-5-1-3-6(8)4-2-5/h1-4H,8H2 CH$LINK: INCHIKEY QSNSCYSYFYORTR-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$SPLASH: splash10-004i-7900000000-a2f8dccba0c4f29cf5f5 PK$NUM_PEAK: 37 PK$PEAK: m/z int. rel.int. 37 3.6 36 38 3.83 38 39 7.56 76 40 1.37 14 41 3.88 39 42 1.12 11 44 1.42 14 44.5 1.81 18 45.5 8.63 86 50 2.75 28 51 1.82 18 52 3.98 40 55 1.03 10 61 2.45 25 62 3.58 36 63 7.32 73 63.5 6.73 67 64 5.55 56 64.5 2.16 22 65 23.98 240 66 3 30 73 3.73 37 74 1.37 14 75 1.81 18 90 2.11 21 91 4.81 48 92 16.81 168 93 1.22 12 99 5.89 59 100 8.15 82 101 2.65 27 102 2.65 27 126 2.11 21 127 99.99 999 128 7.37 74 129 31.7 317 130 2.36 24 //