ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005284
RECORD_TITLE: ALLYL CHLORIDE; EI-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$NAME: ALLYL CHLORIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₃H₅Cl
CH$EXACT_MASS: 76.00798
CH$SMILES: C=CCCl
CH$IUPAC: InChI=1S/C3H5Cl/c1-2-3-4/h2H,1,3H2
CH$LINK: INCHIKEY OSDWBNJEKMUWAV-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID4039231

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$SPLASH: splash10-0006-9000000000-63087e52fce1ba624cbd
PK$NUM_PEAK: 17
PK$PEAK: m/z int. rel.int.
  15 1.76 18
  26 2.75 28
  27 6.4 64
  28 3.08 31
  36 1.09 11
  37 5.31 53
  38 7.31 73
  39 45.94 459
  40 7.92 79
  41 99.99 999
  42 3.75 38
  49 3.37 34
  51 1.14 11
  75 3.6 36
  76 29.38 294
  77 1.95 20
  78 9.49 95
//