ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008602
RECORD_TITLE: 4-METHOXYPHENYLACETONE; 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$NAME: 4-METHOXYPHENYLACETONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₂O₂
CH$EXACT_MASS: 164.08373
CH$SMILES: COc(c1)ccc(CC(C)=O)c1
CH$IUPAC: InChI=1S/C10H12O2/c1-8(11)7-9-3-5-10(12-2)6-4-9/h3-6H,7H2,1-2H3
CH$LINK: INCHIKEY WFWKNGZODAOLEO-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID9059545

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$SPLASH: splash10-00di-5900000000-44778fdb56d419362f0b
PK$NUM_PEAK: 22
PK$PEAK: m/z int. rel.int.
  15 2.86 29
  27 1.16 12
  39 3.18 32
  41 1.42 14
  43 14.48 145
  50 2.25 23
  51 5.33 53
  52 4.12 41
  53 1.17 12
  63 2.51 25
  65 1.82 18
  77 10.03 100
  78 12.74 127
  79 1.24 12
  89 1.95 20
  90 1.33 13
  91 4.3 43
  106 1.38 14
  121 99.99 999
  122 9.02 90
  164 11.42 114
  165 1.12 11
//