MassBank Record: JP008615



 ALPHA-METHYLANISALACETONE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP008615
RECORD_TITLE: ALPHA-METHYLANISALACETONE; EI-B; MS
DATE: 2016.01.19 (2008.10.21, 2011.05.06)
AUTHORS: , SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA

CH$NAME: ALPHA-METHYLANISALACETONE CH$NAME: 5-(4-METHOXYPHENYL)-4-PENTEN-3-ONE CH$COMPOUND_CLASS: N/A CH$FORMULA: C12H14O2 CH$EXACT_MASS: 190.09938 CH$SMILES: CCC(=O)C=Cc(c1)ccc(OC)c1 CH$IUPAC: InChI=1S/C12H14O2/c1-3-11(13)7-4-10-5-8-12(14-2)9-6-10/h4-9H,3H2,1-2H3/b7-4+ CH$LINK: INCHIKEY SLDQOBRACOQXGE-QPJJXVBHSA-N
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$SPLASH: splash10-03di-3900000000-9e477ebf4e87fe2634e2 PK$NUM_PEAK: 47 PK$PEAK: m/z int. rel.int. 15 2.02 20 26 1.16 12 27 5.54 55 29 5.27 53 38 1.19 12 39 3.01 30 44 1.82 18 50 1.9 19 51 3.13 31 53 1.06 11 55 2.01 20 57 1.9 19 62 1.8 18 63 6.18 62 64 3.32 33 65 1.43 14 75 1.77 18 76 1.74 17 77 7.19 72 78 1.39 14 79 2.16 22 89 7.96 80 90 8.07 81 91 2.32 23 92 3.74 37 101 1.14 11 102 3.16 32 103 3.84 38 108 1.1 11 115 1.76 18 117 1.73 17 118 7.1 71 119 1.33 13 132 1.01 10 133 29.08 291 134 2.67 27 146 1.22 12 157 1.72 17 159 1.07 11 161 99.99 999 162 8.55 86 173 1.53 15 187 2.38 24 188 3.9 39 189 1.39 14 190 19.26 193 191 2.01 20 //