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(1S,2S,3R,4R)-2-[3(R)-ETHYLMERCAPTOOCT-1E-ENYL]-3-(2,2-DIETHOXYETHYL)BICYCLO[2.2.1]HEPTANE
SpectraBase Compound ID DtKhIMwWG90
InChI InChI=1S/C23H42O2S/c1-5-9-10-11-20(26-8-4)14-15-21-18-12-13-19(16-18)22(21)17-23(24-6-2)25-7-3/h14-15,18-23H,5-13,16-17H2,1-4H3/b15-14+/t18-,19+,20+,21+,22+/m1/s1
InChIKey YUQCIYUUQATPBS-OZPUTJMUSA-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 43zw0lxMLHR
Name (1S,2S,3R,4R)-2-[3(R)-ETHYLMERCAPTOOCT-1E-ENYL]-3-(2,2-DIETHOXYETHYL)BICYCLO[2.2.1]HEPTANE
Comments =
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Formula C23H42O2S
InChI InChI=1S/C23H42O2S/c1-5-9-10-11-20(26-8-4)14-15-21-18-12-13-19(16-18)22(21)17-23(24-6-2)25-7-3/h14-15,18-23H,5-13,16-17H2,1-4H3/b15-14+/t18-,19+,20+,21+,22+/m1/s1
InChIKey YUQCIYUUQATPBS-OZPUTJMUSA-N
Instrument Name Bruker AM-300
Literature Reference M.S.MIFTAKHOV, F.A.VALEEV, I.N.GAISINA, G.A.TOLSTIKOV (1993)Zhurn.Org.Khim.(Russ. Lang.): v.29, N1, 207-209.
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported