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8a,13-Diamino-labdane
SpectraBase Compound ID HGDMXfG2HHc
InChI InChI=1S/C20H40N2/c1-7-18(4,21)13-9-16-19(5)12-8-11-17(2,3)15(19)10-14-20(16,6)22/h15-16H,7-14,21-22H2,1-6H3
InChIKey KZQHPESROVNOQZ-UHFFFAOYSA-N
Mol Weight 308.6 g/mol
Molecular Formula C20H40N2
Exact Mass 308.319149 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LXaEFZ0EVFz
Name 8a,13-Diamino-labdane
CAS Registry Number 59633-31-7
Comments ISOMER 1 WITH RESPECT TO CONSTITUTION AT C13 ,SHIFTS OF C14 AND C16 ARE INTERCHANGABLE BETWEEN BOTH ISOMERS
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H40N2
InChI InChI=1S/C20H40N2/c1-7-18(4,21)13-9-16-19(5)12-8-11-17(2,3)15(19)10-14-20(16,6)22/h15-16H,7-14,21-22H2,1-6H3
InChIKey KZQHPESROVNOQZ-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference A. Pancrazi, Q. Khuong-Huu, J. Chem. Soc. Perkin II 918 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3