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Dibutylphthalate
SpectraBase Compound ID EHIlsyqcXGf
InChI 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
InChIKey DOIRQSBPFJWKBE-UHFFFAOYSA-N
Mol Weight 278.35 g/mol
Molecular Formula C16H22O4
Exact Mass 278.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 44yH9mkb4cu
Name Dibutyl phthalate
Source of Sample Sigma-Aldrich Cat. #524980
CAS Registry Number 84-74-2
Classification Pesticides: Insecticides, Repellents
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 278.151809184 u
Formula C16H22O4
InChI 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
InChIKey DOIRQSBPFJWKBE-UHFFFAOYSA-N
Molecular Weight 278.348 g/mol
Number of Peaks 48
RI1 1952
SMILES c1(c(cccc1)C(OCCCC)=O)C(=O)OCCCC
SPLASH splash10-0002-2900000000-5963a8a37a4bacb7530b
Sample Comments RI1: measured on SLB-5ms (Alkanes) RI2: measured on Equity-1 (Alkanes)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 1,2-Benzenedicarboxylic acid, 1,2-dibutyl ester
Wiley ID LM_PEST_458