ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010938
RECORD_TITLE: CYCLOHEXYLBENZENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KURARAY CO., LTD.
LICENSE: CC BY-NC-SA

CH$NAME: CYCLOHEXYLBENZENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₂H₁₆
CH$EXACT_MASS: 160.12520
CH$SMILES: C(C2)CCC(C2)c(c1)cccc1
CH$IUPAC: InChI=1S/C12H16/c1-3-7-11(8-4-1)12-9-5-2-6-10-12/h1,3-4,7-8,12H,2,5-6,9-10H2
CH$LINK: INCHIKEY IGARGHRYKHJQSM-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID3061188

AC$INSTRUMENT: JEOL JMS-D-300
AC$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$SPLASH: splash10-0i03-3900000000-7ee94bc25e5f347e612d
PK$NUM_PEAK: 19
PK$PEAK: m/z int. rel.int.
  41 10.4 104
  57 8.5 85
  65 5.6 56
  67 7.9 79
  69 5.9 59
  77 7.2 72
  78 7.8 78
  82 4.5 45
  91 51.8 518
  92 20.9 209
  103 7.3 73
  104 99.99 999
  105 15 150
  115 12.4 124
  117 80.4 804
  118 15.3 153
  131 10 100
  160 74.2 742
  161 10.4 104
//