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6-(BENZYLAMINO)-5-CYANO-2-METHYLNICOTINIC_ACID_ETHYLESTER
SpectraBase Compound ID 9uoyPp3hs0M
InChI InChI=1S/C17H17N3O2/c1-3-22-17(21)15-9-14(10-18)16(20-12(15)2)19-11-13-7-5-4-6-8-13/h4-9H,3,11H2,1-2H3,(H,19,20)
InChIKey RZEINOPOLDPXRL-UHFFFAOYSA-N
Mol Weight 295.34 g/mol
Molecular Formula C17H17N3O2
Exact Mass 295.132077 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KNdEipCi01F
Name 6-(BENZYLAMINO)-5-CYANO-2-METHYLNICOTINIC_ACID_ETHYLESTER
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H17N3O2
InChI InChI=1S/C17H17N3O2/c1-3-22-17(21)15-9-14(10-18)16(20-12(15)2)19-11-13-7-5-4-6-8-13/h4-9H,3,11H2,1-2H3,(H,19,20)
InChIKey RZEINOPOLDPXRL-UHFFFAOYSA-N
Literature Reference Author C.DELOSRIOS,J.EGEA,J.MARCO-CONTELLES,R.LEON,A.SAMADI,I.IRIEP A,I.MORALEDA,E.GALVE
Literature Reference Citation J.MED.CHEM.,53,5129(2010)
Literature Reference DOI 10.1021/jm901902w
Molecular Weight 295.341 g/mol
Solvent CDCl3
Source File Reference UWMZ47394