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Dimethylphthalate
SpectraBase Compound ID 4M9aakLDY14
InChI InChI=1S/C10H10O4/c1-13-9(11)7-5-3-4-6-8(7)10(12)14-2/h3-6H,1-2H3
InChIKey NIQCNGHVCWTJSM-UHFFFAOYSA-N
Mol Weight 194.19 g/mol
Molecular Formula C10H10O4
Exact Mass 194.057909 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A5RUTUwZTAq
Name Dimethyl phthalate
Source of Sample Sigma-Aldrich Cat. #41320
CAS Registry Number 131-11-3
Classification Pesticides: 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 194.057908798 u
Formula C10H10O4
InChI InChI=1S/C10H10O4/c1-13-9(11)7-5-3-4-6-8(7)10(12)14-2/h3-6H,1-2H3
InChIKey NIQCNGHVCWTJSM-UHFFFAOYSA-N
Molecular Weight 194.186 g/mol
Number of Peaks 45
RI1 1448
SMILES COC(c1ccccc1C(=O)OC)=O
SPLASH splash10-03di-3900000000-861c0da2f4f1b98e9c3c
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-dimethyl ester
Wiley ID LM_PEST_460