MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP004908
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004908
RECORD_TITLE: 1,1,2,2-TETRACHLOROETHANE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA
CH$NAME: 1,1,2,2-TETRACHLOROETHANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C2H2Cl4
CH$EXACT_MASS: 165.89106
CH$SMILES: ClC(Cl)C(Cl)Cl
CH$IUPAC: InChI=1S/C2H2Cl4/c3-1(4)2(5)6/h1-2H
CH$LINK: CAS
79-34-5
CH$LINK: INCHIKEY
QPFMBZIOSGYJDE-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID7021318
AC$INSTRUMENT: JEOL JMS-D-3000
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: splash10-001r-9100000000-40ddb7760ad76f76ef2c
PK$NUM_PEAK: 23
PK$PEAK: m/z int. rel.int.
47 1.39 14
48 1.29 13
60 4.16 42
61 4.52 45
62 1.45 15
63 1.37 14
83 99.99 999
84 1.33 13
85 65.21 652
87 10.48 105
95 8 80
96 5.46 55
97 5.12 51
98 3.39 34
130 1.21 12
131 7.78 78
132 1.29 13
133 7.19 72
135 2.85 29
137 1 10
166 5.25 53
168 6.66 67
170 3.23 32
//
system version 2.2.8-SNAPSHOT