ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004594
RECORD_TITLE: 1-(2-METHOXYPHENYL)-5-METHYL-4-HEXENE-1-ONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KATO T, DEPT. OF CHEM., FAC. OF SCI., TOHOKU UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: 1-(2-METHOXYPHENYL)-5-METHYL-4-HEXENE-1-ONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C14H18O2
CH$EXACT_MASS: 218.13068
CH$SMILES: CC(C)=CCCC(=O)c(c1)c(OC)ccc1
CH$IUPAC: InChI=1S/C14H18O2/c1-11(2)7-6-9-13(15)12-8-4-5-10-14(12)16-3/h4-5,7-8,10H,6,9H2,1-3H3
CH$LINK: INCHIKEY YIHSMNILCSBGEM-UHFFFAOYSA-N
AC$INSTRUMENT: Unknown
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 25 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-000i-0920000000-078d4b10c92c8820cb9b
PK$NUM_PEAK: 18
PK$PEAK: m/z int. rel.int.
  77 5.1 51
  121 4.7 47
  135 99.99 999
  136 0.95 10
  137 1.4 14
  147 3.3 33
  150 37.2 372
  151 0.42 4
  161 1.2 12
  162 1.6 16
  163 2.5 25
  175 0.35 4
  185 2.4 24
  200 2.1 21
  203 9.1 91
  204 0.16 2
  218 30.9 309
  219 4.4 44
//
