MassBank Record: JP003306



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

ACCESSION: JP003306
RECORD_TITLE: DIBUTYL 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$NAME: DIBUTYL PHTHALATE CH$COMPOUND_CLASS: N/A CH$FORMULA: C16H22O4 CH$EXACT_MASS: 278.15181 CH$SMILES: CCCCOC(=O)c(c1)c(ccc1)C(=O)OCCCC CH$IUPAC: InChI=1S/C16H22O4/c1-3-5-11-19-15(17)13-9-7-8-10-14(13)16(18)20-12-6-4-2/h7-10H,3-6,11-12H2,1-2H3
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$SPLASH: splash10-0002-1910000000-964b3411de1f914de4da PK$NUM_PEAK: 23 PK$PEAK: m/z int. rel.int. 50 1.6 16 54 1.8 18 55 6.8 68 56 7.3 73 65 3.2 32 76 3.1 31 77 1.4 14 93 0.29 3 104 4.2 42 105 2.6 26 121 2.7 27 122 0.18 2 123 1.4 14 149 99.99 999 150 11 110 151 0.13 1 177 1.4 14 205 11.6 116 206 1.6 16 223 1.62 16 224 2 20 278 5.5 55 279 1.5 15 //