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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008710

M-METHOXYBENZALDEHYDE; EI-B; MS

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

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008710
RECORD_TITLE: M-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$NAME: M-METHOXYBENZALDEHYDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H8O2
CH$EXACT_MASS: 136.05243
CH$SMILES: O=Cc(c1)cc(OC)cc1
CH$IUPAC: InChI=1S/C8H8O2/c1-10-8-4-2-3-7(5-8)6-9/h2-6H,1H3
CH$LINK: INCHIKEY WMPDAIZRQDCGFH-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID5044447

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$SPLASH: splash10-000i-9800000000-8c6402d697d352358d8e
PK$NUM_PEAK: 35
PK$PEAK: m/z int. rel.int.
  15 2.77 28
  18 2.21 22
  27 2.24 22
  29 9.17 92
  37 2.56 26
  38 7.53 75
  39 21.58 216
  49 1.16 12
  50 12.34 123
  51 12.7 127
  52 2.01 20
  53 2.74 27
  61 1.99 20
  62 5.27 53
  63 22.21 222
  64 14.18 142
  65 26.76 268
  66 1.65 17
  73 1.04 10
  74 5.18 52
  75 3.07 31
  76 5.41 54
  77 40.31 403
  78 9.55 96
  79 3.74 37
  92 20.84 208
  93 3.54 35
  105 2.33 23
  106 1.56 16
  107 35.94 359
  108 5.49 55
  119 1.1 11
  135 88.41 884
  136 99.99 999
  137 7.95 80
//

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