ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007056
RECORD_TITLE: CYCLOHEXYL FORMATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA

CH$NAME: CYCLOHEXYL FORMATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₇H₁₂O₂
CH$EXACT_MASS: 128.08373
CH$SMILES: O=COC(C1)CCCC1
CH$IUPAC: InChI=1S/C7H12O2/c8-6-9-7-4-2-1-3-5-7/h6-7H,1-5H2
CH$LINK: CAS 4351-54-6
CH$LINK: INCHIKEY VUXKVKAHWOVIDN-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID2063426

AC$INSTRUMENT: HITACHI M-80B
AC$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$SPLASH: splash10-05o0-9000000000-a2aec3378d1a4e443f77
PK$NUM_PEAK: 29
PK$PEAK: m/z int. rel.int.
  26 1.31 13
  27 14.75 148
  28 2.71 27
  29 19.27 193
  31 4.67 47
  39 18.63 186
  40 2.94 29
  41 32.94 329
  42 6.88 69
  43 9.46 95
  44 12.92 129
  45 1.39 14
  51 2.26 23
  53 6.29 63
  54 37.37 374
  55 28.56 286
  56 4.82 48
  57 41.09 411
  58 2.74 27
  66 1.16 12
  67 99.6 996
  68 6.22 62
  69 1.04 10
  71 1.97 20
  77 1.08 11
  79 2.43 24
  81 8.71 87
  82 99.99 999
  83 19.85 199
//