MassBank Record: JP003236



 4-(2-ACETYL-2-ETHOXYCARBONYL)ETHYL-3,5-DIMETHYLISOXAZOLE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP003236
RECORD_TITLE: 4-(2-ACETYL-2-ETHOXYCARBONYL)ETHYL-3,5-DIMETHYLISOXAZOLE; 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$NAME: 4-(2-ACETYL-2-ETHOXYCARBONYL)ETHYL-3,5-DIMETHYLISOXAZOLE CH$COMPOUND_CLASS: N/A CH$FORMULA: C12H17NO4 CH$EXACT_MASS: 239.11576 CH$SMILES: CCOC(=O)C(C(C)=O)Cc(c(C)1)c(C)on1 CH$IUPAC: InChI=1S/C12H17NO4/c1-5-16-12(15)11(8(3)14)6-10-7(2)13-17-9(10)4/h11H,5-6H2,1-4H3
AC$INSTRUMENT: HITACHI RMU-6E AC$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$SPLASH: splash10-0296-9700000000-da0c6e7aa5ef2a9435fb PK$NUM_PEAK: 8 PK$PEAK: m/z int. rel.int. 239 7 70 196 36 360 166 17 170 124 21 210 110 72 720 68 58 580 43 99.99 999 42 23 230 //