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(1S*,2S*,3R*,6R*,7S*,9R*)-2-THIOCYANATONEOPUPUKAENANE
SpectraBase Compound ID 3Hpg6pa4kpU
InChI InChI=1S/C16H25NS/c1-10(2)11-7-13-15(3)5-6-16(13,4)14(18-9-17)12(11)8-15/h10-14H,5-8H2,1-4H3/t11-,12+,13+,14+,15-,16-/m1/s1
InChIKey PAPMPNGRDPJGLL-FOLNQXHWSA-N
Mol Weight 263.44 g/mol
Molecular Formula C16H25NS
Exact Mass 263.170771 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 45BdztzFy4B
Name (1S*,2S*,3R*,6R*,7S*,9R*)-2-THIOCYANATONEOPUPUKAENANE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H25NS
InChI InChI=1S/C16H25NS/c1-10(2)11-7-13-15(3)5-6-16(13,4)14(18-9-17)12(11)8-15/h10-14H,5-8H2,1-4H3/t11-,12+,13+,14+,15-,16-/m1/s1
InChIKey PAPMPNGRDPJGLL-FOLNQXHWSA-N
Literature Reference Author H.Y.HE,J.SALVA,R.F.CATALOS,D.J.FAULKNER
Literature Reference Citation J.ORG.CHEM.,57,3191(1992)
Literature Reference DOI 10.1021/jo00037a042
Molecular Weight 263.441 g/mol
Solvent CDCl3
Source File Reference UWCS3973