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2,2-Dicyano-3-phenyl-cyclopropanecarboxylic acid ethyl ester
SpectraBase Compound ID F4rHO0yUBNN
InChI InChI=1S/C14H12N2O2/c1-2-18-13(17)12-11(14(12,8-15)9-16)10-6-4-3-5-7-10/h3-7,11-12H,2H2,1H3
InChIKey QLZFLGIJZASHFR-UHFFFAOYSA-N
Mol Weight 240.26 g/mol
Molecular Formula C14H12N2O2
Exact Mass 240.089878 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C2joYk8TA7u
Name 2,2-Dicyano-3-phenyl-cyclopropanecarboxylic acid ethyl ester
Alternate Name(s) Ethyl 1,1-dicyano-2-phenylcyclopropanecarboxylate ethyl 2,2-dicyano-3-phenylcyclopropanecarboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C14H12N2O2
InChI InChI=1S/C14H12N2O2/c1-2-18-13(17)12-11(14(12,8-15)9-16)10-6-4-3-5-7-10/h3-7,11-12H,2H2,1H3
InChIKey QLZFLGIJZASHFR-UHFFFAOYSA-N
Molecular Weight 240.262 g/mol
SMILES C1(C(C(=O)OCC)C1c1ccccc1)(C#N)C#N
SPLASH splash10-014i-0900000000-1a2596195960edf34cb6
Source of Spectrum F-52-2809-2
Wiley ID 795474