MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP006060

1,1,2-TRICHLOROETHANE; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006060
RECORD_TITLE: 1,1,2-TRICHLOROETHANE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HASHIMOTO K, KYOTO COLLEGE OF PHARMACY
LICENSE: CC BY-NC-SA

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CH$NAME: 1,1,2-TRICHLOROETHANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₂H₃Cl₃
CH$EXACT_MASS: 131.93003
CH$SMILES: ClCC(Cl)Cl
CH$IUPAC: InChI=1S/C2H3Cl3/c3-1-2(4)5/h2H,1H2
CH$LINK: INCHIKEY UBOXGVDOUJQMTN-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID5021380

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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 20 eV

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MS$FOCUSED_ION: ION_TYPE [M]+*

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PK$SPLASH: splash10-0002-9000000000-acfcf70e606dda8c87e1
PK$NUM_PEAK: 23
PK$PEAK: m/z int. rel.int.
  27 1.73 17
  49 3.95 40
  51 1.17 12
  61 27.94 279
  62 3.07 31
  63 9.35 94
  83 90.59 906
  84 1.26 13
  85 58.94 589
  87 9.46 95
  95 2.02 20
  96 19.88 199
  97 99.99 999
  98 15.49 155
  99 64.95 650
  100 3.64 36
  101 10.56 106
  132 9.74 97
  133 0.44 4
  134 9.57 96
  135 0.27 3
  136 3.15 32
  138 0.34 3
//