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C(6)-S-ETHYL-BICYCLOMYCIN

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C(6)-S-ETHYL-BICYCLOMYCIN
SpectraBase Compound ID F14TCeQkwgr
InChI InChI=1S/C14H22N2O6S/c1-4-23-14-8(2)5-6-22-13(10(19)16-14,15-11(14)20)9(18)12(3,21)7-17/h9,17-18,21H,2,4-7H2,1,3H3,(H,15,20)(H,16,19)/t9?,12?,13-,14-/m1/s1
InChIKey POLMHZAWAKRNRL-IHTYDXCYSA-N
Mol Weight 346.4 g/mol
Molecular Formula C14H22N2O6S
Exact Mass 346.119858 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EtAlSMosU4q
Name C(6)-S-ETHYL-BICYCLOMYCIN
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H22N2O6S
InChI InChI=1S/C14H22N2O6S/c1-4-23-14-8(2)5-6-22-13(10(19)16-14,15-11(14)20)9(18)12(3,21)7-17/h9,17-18,21H,2,4-7H2,1,3H3,(H,15,20)(H,16,19)/t9?,12?,13-,14-/m1/s1
InChIKey POLMHZAWAKRNRL-IHTYDXCYSA-N
Literature Reference Author A.SANTILLAN,H.G.PARK,X.ZHANG,O.S.LEE,W.R.WIDGER,H.KOHN
Literature Reference Citation J.ORG.CHEM.,61,7756(1996)
Literature Reference DOI 10.1021/jo961003q
Molecular Weight 346.398 g/mol
Solvent CD3OD
Source File Reference UWCS21856