ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006898
RECORD_TITLE: 1-BENZYL-2-METHYLPROPYL ACETATE; 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$NAME: 1-BENZYL-2-METHYLPROPYL ACETATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C13H18O2
CH$EXACT_MASS: 206.13068
CH$SMILES: CC(=O)OC(C(C)C)Cc(c1)cccc1
CH$IUPAC: InChI=1S/C13H18O2/c1-10(2)13(15-11(3)14)9-12-7-5-4-6-8-12/h4-8,10,13H,9H2,1-3H3
CH$LINK: INCHIKEY OOYSHHTYKLXILA-UHFFFAOYSA-N
AC$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: splash10-0006-9200000000-197180017029b2572b00
PK$NUM_PEAK: 21
PK$PEAK: m/z int. rel.int.
  15 1.8 18
  27 2.62 26
  39 3.59 36
  41 4.08 41
  43 99.99 999
  44 2.26 23
  51 1.64 16
  55 1.07 11
  63 1.22 12
  65 5.7 57
  73 1.16 12
  77 1.92 19
  89 1.07 11
  91 21.77 218
  92 5.88 59
  103 1.46 15
  115 3.01 30
  131 18.92 189
  132 1.57 16
  146 19.44 194
  147 2.14 21
//
