ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007062
RECORD_TITLE: ANISYL FORMATE; 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$NAME: ANISYL FORMATE
CH$NAME: P-METHOXYBENZYL FORMATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₉H₁₀O₃
CH$EXACT_MASS: 166.06299
CH$SMILES: O=COCc(c1)ccc(OC)c1
CH$IUPAC: InChI=1S/C9H10O3/c1-11-9-4-2-8(3-5-9)6-12-7-10/h2-5,7H,6H2,1H3
CH$LINK: CAS 122-91-8
CH$LINK: INCHIKEY XPDORSROGAZEGY-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID7047649

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$SPLASH: splash10-00di-5900000000-f68b828805d0c2f3d9f5
PK$NUM_PEAK: 37
PK$PEAK: m/z int. rel.int.
  15 1.3 13
  27 1.22 12
  29 8.39 84
  31 1.08 11
  38 1.47 15
  39 6.16 62
  41 1.86 19
  50 4.27 43
  51 9.22 92
  52 5.16 52
  53 1.67 17
  62 1.53 15
  63 5.44 54
  64 2.98 30
  65 4.13 41
  66 1.91 19
  76 1.08 11
  77 15.94 159
  78 12.46 125
  79 1.88 19
  89 4.46 45
  90 3.11 31
  91 9.38 94
  92 4 40
  94 2.41 24
  105 2.33 23
  106 1.43 14
  107 1.38 14
  109 1.72 17
  119 1.38 14
  120 15.65 157
  121 99.99 999
  122 8.38 84
  135 1.88 19
  137 1.08 11
  166 30.7 307
  167 3 30
//