ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000066
RECORD_TITLE: METHYL META HYDROXY BENZOATE; 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$NAME: METHYL META HYDROXY BENZOATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₈O₃
CH$EXACT_MASS: 152.04734
CH$SMILES: COC(=O)c(c1)cc(O)cc1
CH$IUPAC: InChI=1S/C8H8O3/c1-11-8(10)6-3-2-4-7(9)5-6/h2-5,9H,1H3
CH$LINK: INCHIKEY YKUCHDXIBAQWSF-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID50173071

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$SPLASH: splash10-00di-6900000000-c02b0f7c01037be5937e
PK$NUM_PEAK: 21
PK$PEAK: m/z int. rel.int.
  38 2.79 28
  39 14.08 141
  41 1.52 15
  50 1.58 16
  51 1.16 12
  53 2.63 26
  62 2.1 21
  63 6.99 70
  64 4.57 46
  65 25.43 254
  66 2.15 22
  77 1.73 17
  92 3.84 38
  93 45.72 457
  94 4.31 43
  120 2.73 27
  121 99.99 999
  122 8.2 82
  151 1 10
  152 42.98 430
  153 4.1 41
//