ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001825
RECORD_TITLE: PARA-ANISALDEHYDE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA

CH$NAME: PARA-ANISALDEHYDE
CH$NAME: PARA-METHOXYBENZALDEHYDE
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$INSTRUMENT: HITACHI RMU-7M
AC$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$SPLASH: splash10-000i-5900000000-e26ac32161d707d4b67d
PK$NUM_PEAK: 27
PK$PEAK: m/z int. rel.int.
  27 1.13 11
  28 1.58 16
  29 1.41 14
  37 1.13 11
  38 3.44 34
  39 8.07 81
  50 5.64 56
  51 6.77 68
  53 1.41 14
  62 2.26 23
  63 7 70
  64 7.73 77
  65 7.9 79
  74 2.54 25
  75 1.75 18
  76 2.37 24
  77 33.86 339
  78 3.84 38
  79 2.09 21
  92 14.79 148
  93 1.81 18
  105 1.19 12
  107 18.06 181
  108 2.03 20
  135 99.99 999
  136 71.05 711
  137 6.15 62
//