MassBank Record: JP002281



 4-DIMETHOXYMETHYL-3-PHENYL-5-OXOHEXANAL; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP002281
RECORD_TITLE: 4-DIMETHOXYMETHYL-3-PHENYL-5-OXOHEXANAL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: 4-DIMETHOXYMETHYL-3-PHENYL-5-OXOHEXANAL CH$COMPOUND_CLASS: N/A CH$FORMULA: C15H20O4 CH$EXACT_MASS: 264.13616 CH$SMILES: O=CCC(c(c1)cccc1)C(C(C)=O)C(OC)OC CH$IUPAC: InChI=1S/C15H20O4/c1-11(17)14(15(18-2)19-3)13(9-10-16)12-7-5-4-6-8-12/h4-8,10,13-15H,9H2,1-3H3
AC$INSTRUMENT: JEOL JMS-D-3000 AC$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$SPLASH: splash10-0059-5910000000-27ca3eeee38a3431a9e5 PK$NUM_PEAK: 57 PK$PEAK: m/z int. rel.int. 18 1.56 16 28 2.02 20 29 1.96 20 31 15.91 159 43 13.12 131 58 2.44 24 60 2.51 25 68 1.69 17 71 2.46 25 75 99.99 999 76 3.39 34 77 1.89 19 78 2.53 25 85 20.1 201 91 2 20 95 8.45 85 100 5.3 53 101 21.62 216 103 5.85 59 104 14.93 149 105 4.75 48 115 3.92 39 117 1.59 16 123 2.32 23 128 4.74 47 129 11 110 130 5.86 59 131 37.97 380 132 21.03 210 133 2.8 28 141 1.46 15 143 3.83 38 145 4.33 43 146 3.62 36 147 13.42 134 148 1.84 18 154 2.02 20 155 3.64 36 157 22.45 225 158 9.13 91 159 2.63 26 171 8.43 84 172 25.94 259 173 6.47 65 183 1.44 14 185 1.45 15 189 14.18 142 190 3.16 32 199 3.78 38 200 13.38 134 201 3.13 31 204 2.18 22 213 2.02 20 214 20.57 206 215 3.26 33 232 3.46 35 246 4.02 40 //