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Propanedioic acid, (2-methyl-2-octenyl)-, diethyl ester
SpectraBase Compound ID LJSbGK6qEPK
InChI InChI=1S/C16H28O4/c1-5-8-9-10-11-13(4)12-14(15(17)19-6-2)16(18)20-7-3/h11,14H,5-10,12H2,1-4H3/b13-11+
InChIKey YUYLVWXPATYYRP-ACCUITESSA-N
Mol Weight 284.4 g/mol
Molecular Formula C16H28O4
Exact Mass 284.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6XBrGJ02Dct
Name Propanedioic acid, (2-methyl-2-octenyl)-, diethyl ester
Alternate Name(s) Diethyl 2-(2'-methyl-2'-octenyl)malonate Diethyl 2-[(2E)-2-methyl-2-octenyl]malonate
CAS Registry Number 39833-96-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H28O4
InChI InChI=1S/C16H28O4/c1-5-8-9-10-11-13(4)12-14(15(17)19-6-2)16(18)20-7-3/h11,14H,5-10,12H2,1-4H3/b13-11+
InChIKey YUYLVWXPATYYRP-ACCUITESSA-N
Molecular Weight 284.396 g/mol
SMILES C(C(=O)OCC)(C(=O)OCC)C\C(=C\CCCCC)C
SPLASH splash10-03dr-0900000000-2ea682b33d4ed5493f6b
Source of Spectrum C-100-3422-0
Wiley ID 1287946