MassBank Record: JP003370



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

ACCESSION: JP003370
RECORD_TITLE: ETHOXYCARBONYLMETHYL ETHYL PHTHALATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KOGA M, UNIV. OF OCCUPATIONAL AND ENVIRONMENTAL HEALTH
LICENSE: CC BY-NC-SA

CH$NAME: ETHOXYCARBONYLMETHYL ETHYL PHTHALATE CH$NAME: ETHYL PHTHALYL ETHYL GLYCOLATE CH$COMPOUND_CLASS: N/A CH$FORMULA: C14H16O6 CH$EXACT_MASS: 280.09469 CH$SMILES: CCOC(=O)COC(=O)c(c1)c(ccc1)C(=O)OCC CH$IUPAC: InChI=1S/C14H16O6/c1-3-18-12(15)9-20-14(17)11-8-6-5-7-10(11)13(16)19-4-2/h5-8H,3-4,9H2,1-2H3
AC$INSTRUMENT: JEOL JMS-01-SG-2 AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 75 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-002b-2900000000-bae7c7c2b10536d0f13b PK$NUM_PEAK: 26 PK$PEAK: m/z int. rel.int. 43 2.6 26 45 2.1 21 50 7.1 71 51 2.1 21 58 3.9 39 65 8.6 86 66 4.1 41 75 0.22 2 76 13.4 134 77 4.8 48 87 3.9 39 88 0.76 8 93 6.9 69 104 13.5 135 105 9.6 96 121 0.6 6 132 4.7 47 149 99.99 999 150 8.2 82 163 0.21 2 176 10.4 104 177 42.2 422 178 4.9 49 235 2.94 29 236 5.2 52 280 9.2 92 //