MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP000029
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000029
RECORD_TITLE: 1,2-DICHLOROBENZENE; 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$NAME: 1,2-DICHLOROBENZENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H4Cl2
CH$EXACT_MASS: 145.96901
CH$SMILES: Clc(c1)c(Cl)ccc1
CH$IUPAC: InChI=1S/C6H4Cl2/c7-5-3-1-2-4-6(5)8/h1-4H
CH$LINK: INCHIKEY
RFFLAFLAYFXFSW-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID6020430
AC$INSTRUMENT: Unknown
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0002-2900000000-2055e8573d63130a5bba
PK$NUM_PEAK: 22
PK$PEAK: m/z int. rel.int.
51 4.3 43
55 7.99 80
56 3.08 31
61 2.17 22
73 10.08 101
74 14.68 147
75 26.24 262
76 3.12 31
84 3.47 35
85 3.6 36
109 2.25 23
110 5.78 58
111 41.93 419
112 4.91 49
113 13.51 135
128 2.25 23
145 2.78 28
146 99.99 999
147 7.99 80
148 60.88 609
149 5.86 59
150 9.82 98
//
system version 2.2.8-SNAPSHOT