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4-(4-HYDROXYBUTYL)-5H-[1,2,3]-OXATHIAZOLINE-2,2-DIOXIDE+3,6-DIOXA-2-THIA-SPIRO-[4,5]-DECANE-2,2-DIOXIDE;MIXTURE
SpectraBase Compound ID GlIkQcbdhYm
InChI InChI=1S/2C6H11NO4S/c8-12(9)7-6(5-11-12)3-1-2-4-10-6;8-4-2-1-3-6-5-11-12(9,10)7-6/h7H,1-5H2;8H,1-5H2
InChIKey KJMNCBMCGSJOKK-UHFFFAOYSA-N
Mol Weight 386.43 g/mol
Molecular Formula C12H22N2O8S2
Exact Mass 386.081758 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Eaa0dWibpwT
Name 4-(4-HYDROXYBUTYL)-5H-[1,2,3]-OXATHIAZOLINE-2,2-DIOXIDE+3,6-DIOXA-2-THIA-SPIRO-[4,5]-DECANE-2,2-DIOXIDE;MIXTURE
Compound Number CO MPOUND-#14+#14A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H22N2O8S2
InChI InChI=1S/2C6H11NO4S/c8-12(9)7-6(5-11-12)3-1-2-4-10-6;8-4-2-1-3-6-5-11-12(9,10)7-6/h7H,1-5H2;8H,1-5H2
InChIKey KJMNCBMCGSJOKK-UHFFFAOYSA-N
Literature Reference Author S.TOUMIEUX,P.COMPAIN,O.R.MARTIN,M.SELKTI
Literature Reference Citation ORG.LETTERS,8,4493(2006)
Literature Reference DOI 10.1021/ol061649x
Molecular Weight 386.435 g/mol
Sample ID 61616
Solvent CDCl3