ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008708
RECORD_TITLE: 4-METHOXYBENZALDEHYDE; 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$NAME: 4-METHOXYBENZALDEHYDE
CH$NAME: ANISALDEHYDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₈O₂
CH$EXACT_MASS: 136.05243
CH$SMILES: O=Cc(c1)ccc(OC)c1
CH$IUPAC: InChI=1S/C8H8O2/c1-10-8-4-2-7(6-9)3-5-8/h2-6H,1H3
CH$LINK: INCHIKEY ZRSNZINYAWTAHE-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID2026997

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$SPLASH: splash10-000i-8900000000-d51f38f91dea18a7ca2b
PK$NUM_PEAK: 30
PK$PEAK: m/z int. rel.int.
  15 3.39 34
  27 1.9 19
  29 6.22 62
  37 2.47 25
  38 6.62 66
  39 16.43 164
  50 9.44 94
  51 10.6 106
  52 1.46 15
  53 2.04 20
  61 1.71 17
  62 4.09 41
  63 13.55 136
  64 11.79 118
  65 12.63 126
  66 1.57 16
  74 4.31 43
  75 2.63 26
  76 3.6 36
  77 34.65 347
  78 4.25 43
  79 2.31 23
  92 21 210
  93 3.01 30
  105 1.12 11
  107 9.68 97
  108 1.52 15
  135 99.99 999
  136 73.7 737
  137 5.4 54
//