ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009520
RECORD_TITLE: BROMOTRICHLOROMETHANE; 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$NAME: BROMOTRICHLOROMETHANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: CBrCl₃
CH$EXACT_MASS: 195.82490
CH$SMILES: ClC(Cl)(Cl)Br
CH$IUPAC: InChI=1S/CBrCl3/c2-1(3,4)5
CH$LINK: CAS 75-62-7
CH$LINK: INCHIKEY XNNQFQFUQLJSQT-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID7023930

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$SPLASH: splash10-014i-5900000000-d5639ffc9c2042fe8623
PK$NUM_PEAK: 29
PK$PEAK: m/z int. rel.int.
  11 2.29 23
  35 30.83 308
  36 1.85 19
  37 7.13 71
  47 42.9 429
  49 12.75 128
  79 12.75 128
  80 1.13 11
  81 28.76 288
  82 36.38 364
  84 22.74 227
  86 3.21 32
  91 5.55 56
  93 5.33 53
  114 1.04 10
  116 1.39 14
  117 99.03 990
  118 1.34 13
  119 99.99 999
  120 1.07 11
  121 31.27 313
  123 3.47 35
  126 3.26 33
  128 4.66 47
  130 1.09 11
  161 24.68 247
  163 39.39 394
  165 17.53 175
  167 2.49 25
//