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9-CYANO-NEOCRYPTOLEPINE
SpectraBase Compound ID FmWfV6IwAJv
InChI InChI=1S/C17H11N3/c1-20-16-5-3-2-4-12(16)9-14-13-8-11(10-18)6-7-15(13)19-17(14)20/h2-9H,1H3
InChIKey QDRHDENERCXZPS-UHFFFAOYSA-N
Mol Weight 257.3 g/mol
Molecular Formula C17H11N3
Exact Mass 257.095297 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 19RxxD4SLLG
Name 9-CYANO-NEOCRYPTOLEPINE
Compound Number 1K
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H11N3
InChI InChI=1S/C17H11N3/c1-20-16-5-3-2-4-12(16)9-14-13-8-11(10-18)6-7-15(13)19-17(14)20/h2-9H,1H3
InChIKey QDRHDENERCXZPS-UHFFFAOYSA-N
Literature Reference Author T.H.M.JONCKERS,S.V.MIERT,K.CIMANGA,C.BAILLY,P.COLSON,M.C.D.P AUW-GILLET,H.V.D.HEU
Literature Reference Citation J.MED.CHEM.,45,3497(2002)
Literature Reference DOI 10.1021/jm011102i
Molecular Weight 257.294 g/mol
Sample ID 64933
Solvent CDCl3