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(1S,2S,3R,4R)-2-[1(R)-ETHYLMERCAPTOOCT-2E-ENYL]-3-(2,2-DIETHOXYETHYL)BICYCLO[2.2.1]HEPTANE

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(1S,2S,3R,4R)-2-[1(R)-ETHYLMERCAPTOOCT-2E-ENYL]-3-(2,2-DIETHOXYETHYL)BICYCLO[2.2.1]HEPTANE
SpectraBase Compound ID CA5txtwSeUx
InChI InChI=1S/C23H42O2S/c1-5-9-10-11-12-13-21(26-8-4)23-19-15-14-18(16-19)20(23)17-22(24-6-2)25-7-3/h12-13,18-23H,5-11,14-17H2,1-4H3/b13-12+/t18-,19+,20-,21-,23-/m0/s1
InChIKey YCLYIGCPWVGMFU-VNCRLINMSA-N
Mol Weight 382.6 g/mol
Molecular Formula C23H42O2S
Exact Mass 382.290552 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2QRd6hhxJXI
Name (1S,2S,3R,4R)-2-[1(R)-ETHYLMERCAPTOOCT-2E-ENYL]-3-(2,2-DIETHOXYETHYL)BICYCLO[2.2.1]HEPTANE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C23H42O2S
InChI InChI=1S/C23H42O2S/c1-5-9-10-11-12-13-21(26-8-4)23-19-15-14-18(16-19)20(23)17-22(24-6-2)25-7-3/h12-13,18-23H,5-11,14-17H2,1-4H3/b13-12+/t18-,19+,20-,21-,23-/m0/s1
InChIKey YCLYIGCPWVGMFU-VNCRLINMSA-N
Instrument Name Bruker AM-300
Literature Reference G.A.TOLSTIKOV, F.A.VALEEV, I.N.GAISINA, A.A.BERG, L.M.KHALILOV, L.V.SPIRIKHIN,M.S.MIFTAKHOV (1993) Zhurn.Org.Khim.(Russ. Lang.): v.29, N2, 333-341.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d