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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007220

P-CRESYL ETHYL ETHER; EI-B; MS

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007220
RECORD_TITLE: P-CRESYL ETHYL ETHER; 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$NAME: P-CRESYL ETHYL ETHER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H12O
CH$EXACT_MASS: 136.08882
CH$SMILES: CCOc(c1)ccc(C)c1
CH$IUPAC: InChI=1S/C9H12O/c1-3-10-9-6-4-8(2)5-7-9/h4-7H,3H2,1-2H3
CH$LINK: INCHIKEY WSWPHHNIHLTAHB-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID7060756

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$SPLASH: splash10-0a4i-6900000000-2b46767681701313373f
PK$NUM_PEAK: 29
PK$PEAK: m/z int. rel.int.
  26 2.46 25
  27 19.09 191
  29 10.51 105
  38 1.31 13
  39 11.09 111
  41 1.36 14
  43 1.3 13
  50 4.23 42
  51 12.44 124
  52 7.37 74
  53 7.73 77
  55 1.12 11
  62 1.43 14
  63 4.03 40
  64 1.26 13
  65 9.03 90
  77 25.41 254
  78 8.47 85
  79 15.98 160
  80 9.16 92
  89 2.34 23
  90 8.7 87
  91 10.18 102
  93 1.06 11
  107 75.07 751
  108 99.99 999
  109 7.26 73
  136 55.38 554
  137 4.4 44
//

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