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(1S*,6R*,7R*,10S*,11R*)-10-ISOTHIOCYANATOBIFLORA-1,14-DIENE
SpectraBase Compound ID GuCHxTG2uAP
InChI InChI=1S/C21H33NS/c1-15(2)7-6-8-17(4)18-11-12-21(5,22-14-23)20-10-9-16(3)13-19(18)20/h7,13,17-20H,6,8-12H2,1-5H3/t17-,18+,19+,20-,21-/m0/s1
InChIKey VCGAHYOORHXESQ-ZPAWYTMASA-N
Mol Weight 331.6 g/mol
Molecular Formula C21H33NS
Exact Mass 331.233371 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KMomIXSNysL
Name (1S*,6R*,7R*,10S*,11R*)-10-ISOTHIOCYANATOBIFLORA-1,14-DIENE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H33NS
InChI InChI=1S/C21H33NS/c1-15(2)7-6-8-17(4)18-11-12-21(5,22-14-23)20-10-9-16(3)13-19(18)20/h7,13,17-20H,6,8-12H2,1-5H3/t17-,18+,19+,20-,21-/m0/s1
InChIKey VCGAHYOORHXESQ-ZPAWYTMASA-N
Literature Reference Author G.M.KOENIG,A.D.WRIGHT,C.K.ANGERHOFER
Literature Reference Citation J.ORG.CHEM.,61,3259(1996)
Literature Reference DOI 10.1021/jo952015z
Molecular Weight 331.560 g/mol
Solvent CDCl3
Source File Reference WANG1726