ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000744
RECORD_TITLE: 4-ALLYLANISOLE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: NAKAYAMA M, MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: 4-ALLYLANISOLE
CH$NAME: 1-ALLYL-4-METHOXYBENZENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₂O
CH$EXACT_MASS: 148.08882
CH$SMILES: C=CCc(c1)ccc(OC)c1
CH$IUPAC: InChI=1S/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3,5-8H,1,4H2,2H3
CH$LINK: COMPTOX DTXSID0020575
CH$LINK: INCHIKEY ZFMSMUAANRJZFM-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:8815

AC$INSTRUMENT: HITACHI RMS-4
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 80 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-0002-6900000000-8e0b04a96054353ba4d2
PK$NUM_PEAK: 49
PK$PEAK: m/z int. rel.int.
  39 16 160
  40 16 160
  41 8 80
  43 0.5 5
  50 1 10
  51 21 210
  52 11 110
  53 0.6 6
  55 11 110
  61 1 10
  62 5 50
  63 1.5 15
  64 5 50
  65 12 120
  74 5 50
  75 0.5 5
  76 5 50
  77 38 380
  78 26 260
  79 2.1 21
  89 8 80
  90 4 40
  91 28 280
  92 0.6 6
  93 4 40
  102 5 50
  103 18 180
  104 1 10
  105 29 290
  106 5 50
  107 4 40
  108 0.1 1
  114 1 10
  115 19 190
  116 11 110
  117 3.4 34
  118 6 60
  119 5 50
  120 1 10
  121 4.7 47
  122 5 50
  131 6 60
  132 5 50
  133 2.6 26
  134 4 40
  146 4 40
  147 44 440
  148 99.99 999
  149 15 150
//