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(1R*,2S*,5R*,10S*)-1,6-DIMETHYL-10-ETHOXY-9-(N-PYRIDINIUMSULFINYL)-11-OXATRICYCLO-[5.3.0.1(2,5)]-UNDECAN-6,8-DIENE-CHLORIDE

View entire compound with spectra: 1 NMR

(1R*,2S*,5R*,10S*)-1,6-DIMETHYL-10-ETHOXY-9-(N-PYRIDINIUMSULFINYL)-11-OXATRICYCLO-[5.3.0.1(2,5)]-UNDECAN-6,8-DIENE-CHLORIDE
SpectraBase Compound ID oYqOgvgOLh
InChI InChI=1S/C19H24NO4S.ClH/c1-4-22-18-16(24-25(21)20-10-6-5-7-11-20)12-14-13(2)15-8-9-17(23-15)19(14,18)3;/h5-7,10-12,15,17-18H,4,8-9H2,1-3H3;1H/q+1;/p-1/t15-,17+,18-,19+,25?;/m0./s1
InChIKey MKJAOLBQRXNEEK-XYPQPVKQSA-M
Mol Weight 397.92 g/mol
Molecular Formula C19H24ClNO4S
Exact Mass 397.111457 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FnyFc0EPmKQ
Name (1R*,2S*,5R*,10S*)-1,6-DIMETHYL-10-ETHOXY-9-(N-PYRIDINIUMSULFINYL)-11-OXATRICYCLO-[5.3.0.1(2,5)]-UNDECAN-6,8-DIENE-CHLORIDE
CAS Registry Number 124780-83-2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H24ClNO4S
InChI InChI=1S/C19H24NO4S.ClH/c1-4-22-18-16(24-25(21)20-10-6-5-7-11-20)12-14-13(2)15-8-9-17(23-15)19(14,18)3;/h5-7,10-12,15,17-18H,4,8-9H2,1-3H3;1H/q+1;/p-1/t15-,17+,18-,19+,25?;/m0./s1
InChIKey MKJAOLBQRXNEEK-XYPQPVKQSA-M
Literature Reference Author A.M.MONTANA,K.M.NICHOLAS
Literature Reference Citation J.ORG.CHEM.,55,1569(1990)
Literature Reference DOI 10.1021/jo00292a036
Molecular Weight 397.917 g/mol
Solvent C6D6
Source File Reference UWCS1149