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Pentanedioic acid, 3,3-dimethyl-, dibutyl ester
SpectraBase Compound ID JJ2NvnbD0KU
InChI InChI=1S/C15H28O4/c1-5-7-9-18-13(16)11-15(3,4)12-14(17)19-10-8-6-2/h5-12H2,1-4H3
InChIKey ZECTZBXEBWSWSL-UHFFFAOYSA-N
Mol Weight 272.38 g/mol
Molecular Formula C15H28O4
Exact Mass 272.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4PWQzQWhO4
Name Pentanedioic acid, 3,3-dimethyl-, dibutyl ester
Alternate Name(s) Dibutyl 3,3-dimethylpentanedioate 3,3-Dimethylglutaric acid dibutyl ester 3,3-Dimethylpentanedioic acid dibutyl ester
CAS Registry Number 56051-59-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H28O4
InChI InChI=1S/C15H28O4/c1-5-7-9-18-13(16)11-15(3,4)12-14(17)19-10-8-6-2/h5-12H2,1-4H3
InChIKey ZECTZBXEBWSWSL-UHFFFAOYSA-N
Molecular Weight 272.385 g/mol
SMILES C(C(CC(OCCCC)=O)(C)C)C(OCCCC)=O
SPLASH splash10-0pbd-5900000000-d34d79905bf16c8e0147
Source of Spectrum EP-1240-0-0
Wiley ID 1276167