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(1-S*,4A-R*,9A-R*)-N-ISOPROPYL-1-THIOCYANATO-1,2,3,4,4A,9A-HEXAHYDROCARBAZOLE

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(1-S*,4A-R*,9A-R*)-N-ISOPROPYL-1-THIOCYANATO-1,2,3,4,4A,9A-HEXAHYDROCARBAZOLE
SpectraBase Compound ID 1bJCRh0py0E
InChI InChI=1S/C16H20N2S/c1-11(2)18-14-8-4-3-6-12(14)13-7-5-9-15(16(13)18)19-10-17/h3-4,6,8,11,13,15-16H,5,7,9H2,1-2H3/t13-,15+,16+/m1/s1
InChIKey HJTRQQOZDKGRMD-KBMXLJTQSA-N
Mol Weight 272.41 g/mol
Molecular Formula C16H20N2S
Exact Mass 272.13472 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4IBKO4fnEeH
Name (1-S*,4A-R*,9A-R*)-N-ISOPROPYL-1-THIOCYANATO-1,2,3,4,4A,9A-HEXAHYDROCARBAZOLE
Compound Number IX
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H20N2S
InChI InChI=1S/C16H20N2S/c1-11(2)18-14-8-4-3-6-12(14)13-7-5-9-15(16(13)18)19-10-17/h3-4,6,8,11,13,15-16H,5,7,9H2,1-2H3/t13-,15+,16+/m1/s1
InChIKey HJTRQQOZDKGRMD-KBMXLJTQSA-N
Literature Reference Author R.R.GATAULLIN,F.F.MINNIGULOV,L.V.SPIRIKHIN,I.B.ABDRAKHMANOV
Literature Reference Citation RUSS.J.ORG.CHEM.,40,986(2004)
Literature Reference DOI 10.1023/B:RUJO.0000045190.75301.70
Molecular Weight 272.408 g/mol
Solvent CDCl3
Source File Reference UWMZ16420