MassBank Record: JP003319



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

ACCESSION: JP003319
RECORD_TITLE: DIETHOXYETHYL 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$NAME: DIETHOXYETHYL PHTHALATE CH$COMPOUND_CLASS: N/A CH$FORMULA: C16H22O6 CH$EXACT_MASS: 310.14164 CH$SMILES: CCOCCOC(=O)c(c1)c(ccc1)C(=O)OCCOCC CH$IUPAC: InChI=1S/C16H22O6/c1-3-19-9-11-21-15(17)13-7-5-6-8-14(13)16(18)22-12-10-20-4-2/h5-8H,3-4,9-12H2,1-2H3
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$SPLASH: splash10-00dj-9100000000-47f9c359eac6782f6ed9 PK$NUM_PEAK: 41 PK$PEAK: m/z int. rel.int. 43 17.3 173 44 22.2 222 45 91.4 914 46 2.4 24 50 4.5 45 51 2.4 24 58 15.9 159 65 0.52 5 66 3.3 33 72 99.99 999 73 93.9 939 74 0.4 4 75 2.2 22 76 11.7 117 77 3.9 39 89 0.91 9 90 1 10 91 2.4 24 93 4.5 45 104 1.44 14 105 6 60 121 3.4 34 122 1.2 12 132 0.49 5 133 5.1 51 148 3.8 38 149 35.5 355 150 0.31 3 163 1.6 16 167 1 10 176 10 100 177 0.19 2 193 11.4 114 194 3.1 31 221 9.4 94 222 0.22 2 237 1.2 12 239 1.2 12 265 1.8 18 266 0.73 7 267 1.2 12 //