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Pimelic acid, dimethyl ester
SpectraBase Compound ID GPbVGJNE4cI
InChI InChI=1S/C9H16O4/c1-12-8(10)6-4-3-5-7-9(11)13-2/h3-7H2,1-2H3
InChIKey SHWINQXIGSEZAP-UHFFFAOYSA-N
Mol Weight 188.22 g/mol
Molecular Formula C9H16O4
Exact Mass 188.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1xFYUy0jx2
Name Heptanedioic acid, dimethyl ester
CAS Registry Number 1732-08-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O4
InChI InChI=1S/C9H16O4/c1-12-8(10)6-4-3-5-7-9(11)13-2/h3-7H2,1-2H3
InChIKey SHWINQXIGSEZAP-UHFFFAOYSA-N
Molecular Weight 188.223 g/mol
SMILES C(=O)(CCCCCC(=O)OC)OC
SPLASH splash10-06dl-9300000000-9b3bfb2fc3e004048331
Synonyms Pimelic acid, dimethyl ester Dimethyl 1,7-heptanedioate Dimethyl ester of heptanedioic acid Dimethyl heptanedioate Dimethyl pimelate Heptanedioic acid dimethyl ester AI3-32541 EINECS 217-057-4 NSC 52563
Wiley ID 1496258