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Diethyl 2-allyl-2-[2'-cyano-5'-phenyl-2',5'-pentadienyl]malonate
SpectraBase Compound ID 8gJjSeYN46b
InChI InChI=1S/C22H25NO4/c1-5-15-22(20(24)26-6-2,21(25)27-7-3)19(14-13-17(4)16-23)18-11-9-8-10-12-18/h5,8-14H,1,6-7,15H2,2-4H3/b17-13+,19-14+
InChIKey OFTWWZDUUOTZTO-ATCYZGDMSA-N
Mol Weight 367.45 g/mol
Molecular Formula C22H25NO4
Exact Mass 367.178358 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IdzkG3T9xI2
Name Diethyl 2-allyl-2-[2'-cyano-5'-phenyl-2',5'-pentadienyl]malonate
Alternate Name(s) Diethyl 2-allyl-2-[(1E,3E)-4-cyano-1-phenyl-1,3-pentadienyl]malonate
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Formula C22H25NO4
InChI InChI=1S/C22H25NO4/c1-5-15-22(20(24)26-6-2,21(25)27-7-3)19(14-13-17(4)16-23)18-11-9-8-10-12-18/h5,8-14H,1,6-7,15H2,2-4H3/b17-13+,19-14+
InChIKey OFTWWZDUUOTZTO-ATCYZGDMSA-N
Molecular Weight 367.445 g/mol
SMILES C(\C(=C\C=C\(C#N)C)c1ccccc1)(C(=O)OCC)(C(=O)OCC)CC=C
SPLASH splash10-001i-0098000000-9275ab07588f3481432e
Source of Spectrum SK-24-2871-5
Wiley ID 866465