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benzyl ester 2,4-dicyano-2-methylbutanoic acid ester
SpectraBase Compound ID IvadB8zqTLm
InChI InChI=1S/C14H14N2O2/c1-14(11-16,8-5-9-15)13(17)18-10-12-6-3-2-4-7-12/h2-4,6-7H,5,8,10H2,1H3
InChIKey NJGFAVPOYZIENU-UHFFFAOYSA-N
Mol Weight 242.28 g/mol
Molecular Formula C14H14N2O2
Exact Mass 242.105528 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EdKg7peAvX0
Name benzyl ester 2,4-dicyano-2-methylbutanoic acid ester
CAS Registry Number 125847-83-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14N2O2
InChI InChI=1S/C14H14N2O2/c1-14(11-16,8-5-9-15)13(17)18-10-12-6-3-2-4-7-12/h2-4,6-7H,5,8,10H2,1H3
InChIKey NJGFAVPOYZIENU-UHFFFAOYSA-N
Molecular Weight 242.278 g/mol
SMILES C(C(OCc1ccccc1)=O)(C#N)(CCC#N)C
SPLASH splash10-0006-9410000000-d188d42585d566fef9ae
Source of Spectrum J-55-2512-3
Synonyms benzyl 2,4-dicyano-2-methylbutanoate
Wiley ID 1245123