MassBank Record: JP003364



 TRIS(2-ETHYLHEXYL)PHOSPHATE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP003364
RECORD_TITLE: TRIS(2-ETHYLHEXYL)PHOSPHATE; 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$NAME: TRIS(2-ETHYLHEXYL)PHOSPHATE CH$COMPOUND_CLASS: N/A CH$FORMULA: C24H51O4P CH$EXACT_MASS: 434.35250 CH$SMILES: CCCCC(CC)COP(=O)(OCC(CC)CCCC)OCC(CC)CCCC CH$IUPAC: InChI=1S/C24H51O4P/c1-7-13-16-22(10-4)19-26-29(25,27-20-23(11-5)17-14-8-2)28-21-24(12-6)18-15-9-3/h22-24H,7-21H2,1-6H3
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$SPLASH: splash10-0kmj-9100000000-48bc6d9429f69071c070 PK$NUM_PEAK: 23 PK$PEAK: m/z int. rel.int. 50 2.4 24 51 3.6 36 53 11.8 118 54 76.9 769 55 24.7 247 56 53.5 535 67 12.2 122 68 0.77 8 69 27.1 271 70 71.2 712 71 24.8 248 81 0.32 3 82 3.4 34 83 20.5 205 84 6.1 61 99 99.99 999 111 3.2 32 112 20 200 113 33.6 336 114 0.28 3 211 17.6 176 323 23.2 232 324 4.2 42 //