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1-(3-Cyano-3,3-diphenylpropyl)-4-phenyl-4-piperidinecarboxylic acid
SpectraBase Compound ID 3IzcFKXLbm3
InChI InChI=1S/C28H28N2O2/c29-22-28(24-12-6-2-7-13-24,25-14-8-3-9-15-25)18-21-30-19-16-27(17-20-30,26(31)32)23-10-4-1-5-11-23/h1-15H,16-21H2,(H,31,32)
InChIKey UFIVBRCCIRTJTN-UHFFFAOYSA-N
Mol Weight 424.54 g/mol
Molecular Formula C28H28N2O2
Exact Mass 424.215078 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EpOnA4LQT24
Name 1-(3-Cyano-3,3-diphenylpropyl)-4-phenyl-4-piperidinecarboxylic acid
Alternate Name(s) 1-(3-cyano-3,3-diphenyl-propyl)-4-phenyl-isonipecotic acid 1-(3-cyano-3,3-diphenyl-propyl)-4-phenyl-piperidin-1-ium-4-carboxylate 1-(3-cyano-3,3-diphenyl-propyl)-4-phenyl-piperidine-4-carboxylic acid 1-(3-cyano-3,3-diphenylpropyl)-4-phenyl-4-piperidin-1-iumcarboxylate 4-Piperidinecarboxylic acid, 1-(3-cyano-3,3-diphenylpropyl)-4-phenyl- Difenossina Difenoxilic acid Difenoxin Difenoxina Difenoxine Difenoxinum Difenoxylic acid Diphenoxin Diphenoxylic acid Isonipecotic acid, 1-(3-cyano-3,3-diphenylpropyl)-4-phenyl- Lyspafen Motofen DEA NO. 9167 DEA NO. 9168 McN-JR-15403-11
CAS Registry Number 28782-42-5
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Formula C28H28N2O2
InChI InChI=1S/C28H28N2O2/c29-22-28(24-12-6-2-7-13-24,25-14-8-3-9-15-25)18-21-30-19-16-27(17-20-30,26(31)32)23-10-4-1-5-11-23/h1-15H,16-21H2,(H,31,32)
InChIKey UFIVBRCCIRTJTN-UHFFFAOYSA-N
Molecular Weight 424.544 g/mol
SMILES OC(C1(CCN(CCC(C#N)(c2ccccc2)c2ccccc2)CC1)c1ccccc1)=O
SPLASH splash10-014i-2290000000-e4a92ab7431fd1e5c970
Source of Spectrum JZ-1992-1580-0
Wiley ID 1379454