MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP009413
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009413
RECORD_TITLE: TETRACHLOROETHYLENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA
CH$NAME: TETRACHLOROETHYLENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C2Cl4
CH$EXACT_MASS: 163.87541
CH$SMILES: ClC(Cl)=C(Cl)Cl
CH$IUPAC: InChI=1S/C2Cl4/c3-1(4)2(5)6
CH$LINK: INCHIKEY
CYTYCFOTNPOANT-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID2021319
AC$INSTRUMENT: HITACHI M-80A
AC$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$SPLASH: splash10-02ce-9700000000-15e97c87ff2d3325dcde
PK$NUM_PEAK: 37
PK$PEAK: m/z int. rel.int.
12 11.73 117
24 19.94 199
35 87.35 874
36 1.71 17
37 26.61 266
47 99.99 999
48 1.17 12
49 32.56 326
59 50.44 504
60 1.26 13
61 16.33 163
70 1.53 15
72 1.04 10
82 30.93 309
83 2.91 29
84 19.5 195
86 2.96 30
94 80.34 803
95 1.88 19
96 51.6 516
97 1.14 11
98 8.28 83
117 1.72 17
119 1.57 16
129 97.88 979
130 2.11 21
131 90.72 907
132 1.98 20
133 29.1 291
135 3.04 30
164 79.95 800
165 1.65 17
166 97.4 974
167 2.29 23
168 46.55 466
169 1.03 10
170 9.69 97
//