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TETRA-N-BUTYLAMMONIUM-[3-ALPHA,6-ALPHA,7-ALPHA,8-ALPHA]-5,8-DIMETHYL-9-OXO-1,2-DIAZA-TRICYCLO-[5.2.0.0(3,6)]-NON-4-ENE-2-SULFONATE

View entire compound with spectra: 1 NMR

TETRA-N-BUTYLAMMONIUM-[3-ALPHA,6-ALPHA,7-ALPHA,8-ALPHA]-5,8-DIMETHYL-9-OXO-1,2-DIAZA-TRICYCLO-[5.2.0.0(3,6)]-NON-4-ENE-2-SULFONATE
SpectraBase Compound ID KGxpKLLyaVV
InChI InChI=1S/C16H36N.C9H12N2O4S/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;1-4-3-6-7(4)8-5(2)9(12)10(8)11(6)16(13,14)15/h5-16H2,1-4H3;3,5-8H,1-2H3,(H,13,14,15)/q+1;/p-1
InChIKey CFHNMYOKPPEHKU-UHFFFAOYSA-M
Mol Weight 485.73 g/mol
Molecular Formula C25H47N3O4S
Exact Mass 485.328728 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HvjjVmYK9SG
Name TETRA-N-BUTYLAMMONIUM-[3-ALPHA,6-ALPHA,7-ALPHA,8-ALPHA]-5,8-DIMETHYL-9-OXO-1,2-DIAZA-TRICYCLO-[5.2.0.0(3,6)]-NON-4-ENE-2-SULFONATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H47N3O4S
InChI InChI=1S/C16H36N.C9H12N2O4S/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;1-4-3-6-7(4)8-5(2)9(12)10(8)11(6)16(13,14)15/h5-16H2,1-4H3;3,5-8H,1-2H3,(H,13,14,15)/q+1;/p-1
InChIKey CFHNMYOKPPEHKU-UHFFFAOYSA-M
Literature Reference Author T.TSCHAMBER,J.M.HENLIN,D.PIPE,J.STREITH
Literature Reference Citation HETEROCYCLES,23,2589(1985)
Literature Reference DOI 10.3987/R-1985-10-2589
Molecular Weight 485.726 g/mol
Solvent CDCl3
Source File Reference UWED5148