MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008869
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008869
RECORD_TITLE: PHENYL CHLOROFORMATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA
CH$NAME: PHENYL CHLOROFORMATE
CH$NAME: CHLOROFORMIC ACID PHENYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C7H5ClO2
CH$EXACT_MASS: 155.99781
CH$SMILES: O=C(Cl)Oc(c1)cccc1
CH$IUPAC: InChI=1S/C7H5ClO2/c8-7(9)10-6-4-2-1-3-5-6/h1-5H
CH$LINK: INCHIKEY
AHWALFGBDFAJAI-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID9044403
AC$INSTRUMENT: HITACHI RMU-7M
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: splash10-05r0-9200000000-70c5973f97ae8a7ddf19
PK$NUM_PEAK: 29
PK$PEAK: m/z int. rel.int.
27 1.83 18
35 1.83 18
37 4.02 40
38 10.96 110
38.5 3.65 37
39 31.96 320
44 3.56 36
50 7.21 72
51 12.15 122
61 2.01 20
62 3.74 37
63 29.04 290
64 4.2 42
65 57.99 580
66 3.74 37
74 2.1 21
77 99.99 999
78 6.48 65
93 26.94 269
94 3.84 38
112 12.79 128
114 4.47 45
121 5.57 56
128 3.2 32
130 1.1 11
156 39.73 397
157 3.47 35
158 13.33 133
159 1 10
//
system version 2.2.8-SNAPSHOT