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3-BROMO-NEOCRYPTOLEPINE
SpectraBase Compound ID I2lyAxnI1n7
InChI InChI=1S/C16H11BrN2/c1-19-15-9-11(17)7-6-10(15)8-13-12-4-2-3-5-14(12)18-16(13)19/h2-9H,1H3
InChIKey PKQYBXDXBBMDQQ-UHFFFAOYSA-N
Mol Weight 311.18 g/mol
Molecular Formula C16H11BrN2
Exact Mass 310.010561 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6vJDv2ipI0W
Name 3-BROMO-NEOCRYPTOLEPINE
Compound Number 1W
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H11BrN2
InChI InChI=1S/C16H11BrN2/c1-19-15-9-11(17)7-6-10(15)8-13-12-4-2-3-5-14(12)18-16(13)19/h2-9H,1H3
InChIKey PKQYBXDXBBMDQQ-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 311.181 g/mol
Sample ID 64942
Solvent CDCl3