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Dimethyl ester of 2,4-dicyano-2-(2,3-dimethyl-3-pentenyl)pentanedioic acid
SpectraBase Compound ID GdAGnEAf6yt
InChI InChI=1S/C16H22N2O4/c1-6-11(2)12(3)7-16(10-18,15(20)22-5)8-13(9-17)14(19)21-4/h6,12-13H,7-8H2,1-5H3/b11-6-
InChIKey CXADLFWKVRZWBP-WDZFZDKYSA-N
Mol Weight 306.36 g/mol
Molecular Formula C16H22N2O4
Exact Mass 306.157957 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F18yyV8uhko
Name Dimethyl ester of 2,4-dicyano-2-(2,3-dimethyl-3-pentenyl)pentanedioic acid
Alternate Name(s) Dimethyl 2,4-dicyano-2-[(3Z)-2,3-dimethyl-3-pentenyl]pentanedioate
CAS Registry Number 77257-21-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22N2O4
InChI InChI=1S/C16H22N2O4/c1-6-11(2)12(3)7-16(10-18,15(20)22-5)8-13(9-17)14(19)21-4/h6,12-13H,7-8H2,1-5H3/b11-6-
InChIKey CXADLFWKVRZWBP-WDZFZDKYSA-N
Molecular Weight 306.362 g/mol
SMILES C(C(=O)OC)(CC(C(=O)OC)C#N)(C#N)CC(\C(=C/C)C)C
SPLASH splash10-0pw9-9210000000-c7ca86ba304d9332e22d
Source of Spectrum J-46-2566-0
Wiley ID 1307968