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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008869

PHENYL CHLOROFORMATE; EI-B; MS

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

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
//

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