ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009403
RECORD_TITLE: ISOBUTYL CHLOROFORMATE; 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$NAME: ISOBUTYL CHLOROFORMATE
CH$NAME: 2-METHYLPROPYL CHLOROFORMATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₅H₉ClO₂
CH$EXACT_MASS: 136.02911
CH$SMILES: CC(C)COC(=O)Cl
CH$IUPAC: InChI=1S/C5H9ClO2/c1-4(2)3-8-5(6)7/h4H,3H2,1-2H3
CH$LINK: INCHIKEY YOETUEMZNOLGDB-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID8052194

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$SPLASH: splash10-052f-9000000000-8e1b38400446eb9522ab
PK$NUM_PEAK: 33
PK$PEAK: m/z int. rel.int.
  15 11.04 110
  26 8.85 89
  27 41.03 410
  28 1.24 12
  29 29.5 295
  30 1.17 12
  31 2.28 23
  35 4.71 47
  36 14.16 142
  37 3.01 30
  38 6 60
  39 45.67 457
  40 8.79 88
  41 99.99 999
  42 11.9 119
  43 55.28 553
  44 27.08 271
  45 1.44 14
  49 1.23 12
  50 3.86 39
  51 3.39 34
  53 4.25 43
  54 1.48 15
  55 14.62 146
  56 68.47 685
  57 48.14 481
  58 2.12 21
  62 1.45 15
  63 12.97 130
  65 4.28 43
  77 1.56 16
  94 2.08 21
  95 1.04 10
//