MassBank Record: JP009643



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

ACCESSION: JP009643
RECORD_TITLE: ETHYL 4-CHLORO-3,5-DIMETHYLBENZOATE; EI-B; MS
DATE: 2016.01.19 (2008.10.21, 2011.05.06)
AUTHORS: , THE INSTITUTE OF SCIENTIFIC AND INDUSTRIALRESEARCH
LICENSE: CC BY-NC-SA

CH$NAME: ETHYL 4-CHLORO-3,5-DIMETHYLBENZOATE CH$COMPOUND_CLASS: N/A CH$FORMULA: C11H13ClO2 CH$EXACT_MASS: 212.06041 CH$SMILES: CCOC(=O)c(c1)cc(C)c(Cl)c(C)1 CH$IUPAC: InChI=1S/C11H13ClO2/c1-4-14-11(13)9-5-7(2)10(12)8(3)6-9/h5-6H,4H2,1-3H3 CH$LINK: INCHIKEY LNDNLCSHAZPLIV-UHFFFAOYSA-N
AC$INSTRUMENT: JEOL JMS-DX-300 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: splash10-014i-1910000000-dd3fe7da8707bc3600bc PK$NUM_PEAK: 42 PK$PEAK: m/z int. rel.int. 27 4.5 45 29 4 40 39 3.1 31 45 0.1 1 50 1.5 15 51 6.4 64 52 1.2 12 53 0.17 2 62 1 10 63 3.7 37 65 1.6 16 75 0.2 2 76 1 10 77 18.8 188 78 3.9 39 91 0.15 2 101 1.5 15 102 3.4 34 103 18.7 187 104 0.6 6 105 2.3 23 138 1.2 12 139 15.4 154 140 0.2 2 141 5 50 149 4.4 44 153 1 10 167 99.99 999 168 14.1 141 169 33.3 333 170 4.5 45 177 0.34 3 184 32 320 185 3.5 35 186 10.6 106 197 0.57 6 199 1.7 17 211 1.2 12 212 38.2 382 213 0.5 5 214 12.9 129 215 1.5 15 //

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