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Heptanedioic acid, bis(1-methylpropyl) ester
SpectraBase Compound ID Brm91Mqtkb7
InChI InChI=1S/C15H28O4/c1-5-12(3)18-14(16)10-8-7-9-11-15(17)19-13(4)6-2/h12-13H,5-11H2,1-4H3
InChIKey BJWLETOUSPRRSI-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 9J8t3Zjlneu
Name Heptanedioic acid, bis(1-methylpropyl) ester
Alternate Name(s) Di(sec-butyl) pimelate dibutan-2-yl heptanedioate Disec-butyl heptanedioate Heptanedioic acid dibutan-2-yl ester pimelic acid disec-butyl ester
CAS Registry Number 57983-34-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H28O4
InChI InChI=1S/C15H28O4/c1-5-12(3)18-14(16)10-8-7-9-11-15(17)19-13(4)6-2/h12-13H,5-11H2,1-4H3
InChIKey BJWLETOUSPRRSI-UHFFFAOYSA-N
Molecular Weight 272.385 g/mol
SMILES C(OC(CC)C)(CCCCCC(OC(CC)C)=O)=O
SPLASH splash10-052f-9500000000-1a65d8e88ae5bcc93239
Source of Spectrum W5-24308-0-0
Wiley ID 1276160