MassBank Record: JP001328



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

ACCESSION: JP001328
RECORD_TITLE: DIISOBUTYL PHTHALATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA

CH$NAME: DIISOBUTYL PHTHALATE CH$NAME: PHTHALIC ACID DIISOBUTYL ESTER CH$COMPOUND_CLASS: N/A CH$FORMULA: C16H22O4 CH$EXACT_MASS: 278.15181 CH$SMILES: CC(C)COC(=O)c(c1)c(ccc1)C(=O)OCC(C)C CH$IUPAC: InChI=1S/C16H22O4/c1-11(2)9-19-15(17)13-7-5-6-8-14(13)16(18)20-10-12(3)4/h5-8,11-12H,9-10H2,1-4H3
AC$INSTRUMENT: HITACHI RMU-7M 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: splash10-0002-2900000000-abec18892ce4da3756e0 PK$NUM_PEAK: 15 PK$PEAK: m/z int. rel.int. 29 2.74 27 41 6.13 61 56 2.74 27 57 14.51 145 65 1.75 18 76 3.61 36 93 2.35 24 104 5.15 52 105 1.37 14 121 2.68 27 149 99.99 999 150 8.87 89 167 3.67 37 205 1.59 16 223 2.25 23 //