ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008170
RECORD_TITLE: 2,2-DICHLOROPROPANE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: NARA WOMEN'S UNIVERSITY
LICENSE: CC BY-NC-SA
CH$NAME: 2,2-DICHLOROPROPANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C3H6Cl2
CH$EXACT_MASS: 111.98466
CH$SMILES: CC(C)(Cl)Cl
CH$IUPAC: InChI=1S/C3H6Cl2/c1-3(2,4)5/h1-2H3
CH$LINK: CAS 594-20-7
CH$LINK: INCHIKEY ZEOVXNVKXIPWMS-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID7030060
AC$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 70 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-004i-9000000000-68a2af4d20e4462ffc3c
PK$NUM_PEAK: 27
PK$PEAK: m/z int. rel.int.
  15 2.49 25
  26 1.58 16
  27 2.85 29
  29 2.81 28
  31 6.08 61
  32 6.29 63
  35 1.87 19
  36 1.52 15
  37 2.8 28
  38 4.03 40
  39 14.55 146
  40 2.13 21
  41 42.45 425
  42 1.84 18
  49 2.85 29
  61 9.52 95
  62 1.87 19
  63 4.35 44
  76 2.88 29
  77 99.99 999
  78 4.39 44
  79 34.22 342
  80 1.22 12
  97 18.84 188
  98 0.92 9
  99 12.47 125
  101 2.08 21
//
