MassBank Record: JP000958



 1,1,2-TRICHLOROETHANE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP000958
RECORD_TITLE: 1,1,2-TRICHLOROETHANE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KOGA M, UNIV. OF OCCUPATIONAL AND ENVIRONMENTAL HEALTH
LICENSE: CC BY-NC-SA

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$LINK: CAS 79-00-5
AC$INSTRUMENT: JEOL JMS-01-SG 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: splash10-0002-9000000000-b36dd60ff3a07b029065 PK$NUM_PEAK: 26 PK$PEAK: m/z int. rel.int. 25 2.9 29 26 10.2 102 27 7.8 78 35 0.75 8 36 2.3 23 37 2.6 26 47 4.1 41 48 0.32 3 49 7.8 78 60 9.3 93 61 54.7 547 62 0.96 10 63 17.7 177 83 76 760 85 53 530 87 0.78 8 95 5 50 96 28.3 283 97 99.99 999 98 2.06 21 99 61.7 617 100 4.4 44 101 9.8 98 132 1.57 16 134 15.8 158 136 4.9 49 //