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10-ISOTHIOCYANATOGUAI-6-ENE
SpectraBase Compound ID 1GrInzNnQOc
InChI InChI=1S/C16H25NS/c1-11(2)13-7-8-16(4,17-10-18)15-6-5-12(3)14(15)9-13/h9,11-12,14-15H,5-8H2,1-4H3/t12-,14-,15+,16?/m1/s1
InChIKey BJUXAFSYNWNLTL-SLHHOWHOSA-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 CI68IbOLiqO
Name 10-ISOTHIOCYANATOGUAI-6-ENE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H25NS
InChI InChI=1S/C16H25NS/c1-11(2)13-7-8-16(4,17-10-18)15-6-5-12(3)14(15)9-13/h9,11-12,14-15H,5-8H2,1-4H3/t12-,14-,15+,16?/m1/s1
InChIKey BJUXAFSYNWNLTL-SLHHOWHOSA-N
Literature Reference Author P.JUMARYATNO,B.L.STAPLETON,J.N.A.HOOPER,D.J.BRECKNELL,J.T.BL ANCHFIELD,M.J.GARSON
Literature Reference Citation J.NAT.PROD.,70,1725(2007)
Literature Reference DOI 10.1021/np070156d
Molecular Weight 263.441 g/mol
Sample ID 31013
Solvent CDCl3