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Heptanedioic acid dibutyl ester
SpectraBase Compound ID 1nPD4zGjuuG
InChI InChI=1S/C15H28O4/c1-3-5-12-18-14(16)10-8-7-9-11-15(17)19-13-6-4-2/h3-13H2,1-2H3
InChIKey IQYKLRJIMOPPKB-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 BgvAfhrSY5E
Name Heptanedioic acid, dibutyl ester
CAS Registry Number 51238-94-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H28O4
InChI InChI=1S/C15H28O4/c1-3-5-12-18-14(16)10-8-7-9-11-15(17)19-13-6-4-2/h3-13H2,1-2H3
InChIKey IQYKLRJIMOPPKB-UHFFFAOYSA-N
Molecular Weight 272.385 g/mol
SMILES C(=O)(CCCCCC(=O)OCCCC)OCCCC
SPLASH splash10-054p-9800000000-a6ba0500ae7629c63cd0
Source of Spectrum EP-1232-0-0
Synonyms Dibutyl heptanedioate Dibutyl pimelate pimelic acid dibutyl ester
Wiley ID 1276158