ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005211
RECORD_TITLE: PHENYLACETYL CHLORIDE; CI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: PHENYLACETYL CHLORIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₇ClO
CH$EXACT_MASS: 154.01854
CH$SMILES: O=C(Cl)Cc(c1)cccc1
CH$IUPAC: InChI=1S/C8H7ClO/c9-8(10)6-7-4-2-1-3-5-7/h1-5H,6H2
CH$LINK: INCHIKEY VMZCDNSFRSVYKQ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID6059281

AC$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: CI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV
AC$MASS_SPECTROMETRY: REAGENT_GAS ISOBUTANE

PK$SPLASH: splash10-014i-1900000000-e88c090f05e663a159ca
PK$NUM_PEAK: 15
PK$PEAK: m/z int. rel.int.
  84 1.05 11
  91 20.13 201
  92 4.03 40
  118 6.08 61
  119 99.99 999
  120 9.74 97
  129 1.89 19
  131 4.06 41
  133 3.04 30
  147 8.46 85
  148 1.33 13
  154 33.79 338
  155 10.94 109
  156 14.03 140
  157 4.37 44
//