ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007575
RECORD_TITLE: EUGENOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAKEUCHI T, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: EUGENOL
CH$NAME: 2-METHOXY-4-(2-PROPENYL)PHENOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₂O₂
CH$EXACT_MASS: 164.08373
CH$SMILES: C=CCc(c1)cc(OC)c(O)c1
CH$IUPAC: InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3
CH$LINK: CAS 97-53-0
CH$LINK: INCHIKEY RRAFCDWBNXTKKO-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID9020617

AC$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-03di-2900000000-395df8510f0db4933abe
PK$NUM_PEAK: 20
PK$PEAK: m/z int. rel.int.
  39 5.72 57
  41 3.01 30
  51 6.02 60
  55 10.52 105
  63 2.51 25
  65 4.71 47
  77 14.62 146
  78 4.01 40
  91 10.62 106
  103 15.22 152
  104 9.72 97
  105 5.21 52
  121 10.32 103
  131 19.23 192
  133 13.62 136
  137 17.53 175
  147 4.71 47
  149 31.14 311
  164 99.99 999
  165 11.12 111
//