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Dimethyl ester of (Z)-[9-(dimethylamino)-7-nonenyl]propanedioic acid
SpectraBase Compound ID De3JCwzqZn
InChI InChI=1S/C16H29NO4/c1-17(2)13-11-9-7-5-6-8-10-12-14(15(18)20-3)16(19)21-4/h9,11,14H,5-8,10,12-13H2,1-4H3/b11-9-
InChIKey HDCKAFINBCIKEF-LUAWRHEFSA-N
Mol Weight 299.41 g/mol
Molecular Formula C16H29NO4
Exact Mass 299.209658 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Q8B5pjjPRS
Name Dimethyl ester of (Z)-[9-(dimethylamino)-7-nonenyl]propanedioic acid
Alternate Name(s) Dimethyl 2-[(7Z)-9-(dimethylamino)-7-nonenyl]malonate
CAS Registry Number 94517-91-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H29NO4
InChI InChI=1S/C16H29NO4/c1-17(2)13-11-9-7-5-6-8-10-12-14(15(18)20-3)16(19)21-4/h9,11,14H,5-8,10,12-13H2,1-4H3/b11-9-
InChIKey HDCKAFINBCIKEF-LUAWRHEFSA-N
Molecular Weight 299.411 g/mol
SMILES C(C(=O)OC)(C(=O)OC)CCCCCC\C=C/CN(C)C
SPLASH splash10-0a4s-9040000000-1efa403f6cb25e80b8a2
Source of Spectrum C-107-2128-0
Wiley ID 1301968