John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=15jtNG3AkMJ SpectraBase Spectrum ID=HL0VkgqTPRb

(accessed ).
2-ETHOXYCARBONYL-7-DIMETHYLAMINO-4,5,6,8,9,10A-HEXAHYDRO-4,10A-DIMETHYL-3-OXATHIAZOLO-[2,3-B]-2,6A-DIAZA-3A-AZONIAPHENALENE;PERCHLORATE
SpectraBase Compound ID 15jtNG3AkMJ
InChI InChI=1S/C19H27N4O3S.ClHO4/c1-6-26-18(25)14-11-22-16-13(8-7-12(2)23(16)17(14)24)15(20(4)5)21-9-10-27-19(21,22)3;2-1(3,4)5/h11-12H,6-10H2,1-5H3;(H,2,3,4,5)/q+1;/p-1
InChIKey MYQBUANDRPVXQZ-UHFFFAOYSA-M
Mol Weight 490.96 g/mol
Molecular Formula C19H27ClN4O7S
Exact Mass 490.128899 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HL0VkgqTPRb
Name 2-ETHOXYCARBONYL-7-DIMETHYLAMINO-4,5,6,8,9,10A-HEXAHYDRO-4,10A-DIMETHYL-3-OXATHIAZOLO-[2,3-B]-2,6A-DIAZA-3A-AZONIAPHENALENE;PERCHLORATE
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H27ClN4O7S
InChI InChI=1S/C19H27N4O3S.ClHO4/c1-6-26-18(25)14-11-22-16-13(8-7-12(2)23(16)17(14)24)15(20(4)5)21-9-10-27-19(21,22)3;2-1(3,4)5/h11-12H,6-10H2,1-5H3;(H,2,3,4,5)/q+1;/p-1
InChIKey MYQBUANDRPVXQZ-UHFFFAOYSA-M
Literature Reference Author I.BITTER,B.PETE,B.AGAI,L.TOKE,G.TOTH,I.HERMECZ,K.SIMON,Z.MES ZAROS,L.PARKANYI
Literature Reference Citation HETEROCYCLES,26,2615(1987)
Literature Reference DOI 10.3987/R-1987-10-2615
Molecular Weight 490.959 g/mol
Solvent CDCl3:DMSO-D6
Source File Reference UWED25524
SpectraBase Batch ID HOp3VcxQqxG