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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP011790

PARA-METHOXYPHENOL; EI-B; MS

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

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011790
RECORD_TITLE: PARA-METHOXYPHENOL; 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$NAME: PARA-METHOXYPHENOL
CH$NAME: 4-METHOXYPHENOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C7H8O2
CH$EXACT_MASS: 124.05243
CH$SMILES: COc(c1)ccc(O)c1
CH$IUPAC: InChI=1S/C7H8O2/c1-9-7-4-2-6(8)3-5-7/h2-5,8H,1H3
CH$LINK: INCHIKEY NWVVVBRKAWDGAB-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID4020828

AC$INSTRUMENT: HITACHI M-80A
AC$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$SPLASH: splash10-05fr-3900000000-5f100d415313d60a9ba0
PK$NUM_PEAK: 24
PK$PEAK: m/z int. rel.int.
  26 1.03 10
  27 1.98 20
  29 1.43 14
  38 1.41 14
  39 4.48 45
  41 1.12 11
  50 2.14 21
  51 3.12 31
  52 3.77 38
  53 11.79 118
  54 3.31 33
  55 2.67 27
  64 1.41 14
  65 4.32 43
  80 1.19 12
  81 34.47 345
  82 2.57 26
  93 1.51 15
  95 1.93 19
  109 90.07 901
  110 6.04 60
  123 2.39 24
  124 99.99 999
  125 8.01 80
//

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