ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008505
RECORD_TITLE: HEXYL PHENYLACETATE; 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$NAME: HEXYL PHENYLACETATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₄H₂₀O₂
CH$EXACT_MASS: 220.14633
CH$SMILES: CCCCCCOC(=O)Cc(c1)cccc1
CH$IUPAC: InChI=1S/C14H20O2/c1-2-3-4-8-11-16-14(15)12-13-9-6-5-7-10-13/h5-7,9-10H,2-4,8,11-12H2,1H3
CH$LINK: INCHIKEY MTAHGWGAEGVCLS-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID1063859

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$SPLASH: splash10-0006-9100000000-3b78f236a955e5f6d3db
PK$NUM_PEAK: 27
PK$PEAK: m/z int. rel.int.
  27 9.01 90
  29 10.61 106
  39 9.03 90
  41 21.56 216
  42 5.42 54
  43 99.99 999
  44 2.8 28
  51 2.25 23
  53 1.01 10
  55 7.89 79
  56 5.03 50
  57 11.1 111
  63 2.63 26
  65 13.94 139
  69 1.76 18
  84 2.67 27
  85 5.93 59
  89 2.97 30
  90 2.58 26
  91 84.95 850
  92 24.28 243
  93 1.48 15
  119 1.81 18
  129 7.96 80
  136 23.33 233
  137 9.95 100
  220 1.42 14
//