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CAS Number: 1025687-93-7
tert-butyl 5-cyano-2H-spiro[benzofuran-3,4'-piperidine]-1'-carboxylate

Structure

 tert-butyl 5-cyano-2H-spiro[benzofuran-3,4'-piperidine]-1'-carboxylate
Name: tert-butyl 5-cyano-2H-spiro[benzofuran-3,4'-piperidine]-1'-carboxylate
Synonyms:
General Information
Product Number: 1025687937

CAS Registry Number 1025687-93-7
Name:
Spiro[benzofuran-?3(2H)?,?4'-?piperidine]?-?1'-?carboxylic acid, 5-?cyano-?, 1,?1-?dimethylethyl ester

 

Chemical Formula: C18H22N2O3
Exact Mass: 314.16
Molecular Weight: 314.38
m/z: 314.16 (100.0%), 315.17 (19.8%), 316.17 (2.5%)

 

InChI:InChI=1S/C18H22N2O3/c1-17(2,3)23-16(21)20-8-6-18(7-9-20)12-22-15-5-4-13(11-19)10-14(15)18/h4-5,10H,6-9,12H2,1-3H3

InChI Key:YPIIZIIFPODFDK-UHFFFAOYSA-N

Canonical SMILES:CC(C)(C)OC(=O)N1CCC2(CC1)COC3=C2C=C(C=C3)C#N

Specification

98%
References

PCT Int. Appl. (2009), WO 2009067202 A1 20090528. 

Letters in Drug Design & Discovery (2008), 5(2), 116-121.
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