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2-ETHOXYCARBONYL-7-DIMETHYLAMINO-4,5,6,12A-TETRAHYDRO-4,12A-DIMETHYL-3-OXOBENZOXAZOLO-[2,3-B]-2,6A-DIAZA-3A-AZONIAPHENALENE;PERCHLORATE

View entire compound with spectra: 1 NMR

2-ETHOXYCARBONYL-7-DIMETHYLAMINO-4,5,6,12A-TETRAHYDRO-4,12A-DIMETHYL-3-OXOBENZOXAZOLO-[2,3-B]-2,6A-DIAZA-3A-AZONIAPHENALENE;PERCHLORATE
SpectraBase Compound ID 1PiAbvbV3pf
InChI InChI=1S/C23H27N4O4.ClHO4/c1-6-30-22(29)16-13-25-20-15(12-11-14(2)26(20)21(16)28)19(24(4)5)27-17-9-7-8-10-18(17)31-23(25,27)3;2-1(3,4)5/h7-10,13-14H,6,11-12H2,1-5H3;(H,2,3,4,5)/q+1;/p-1
InChIKey HEGRAFAZAHENEA-UHFFFAOYSA-M
Mol Weight 522.94 g/mol
Molecular Formula C23H27ClN4O8
Exact Mass 522.151742 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4YMTmap8LR6
Name 2-ETHOXYCARBONYL-7-DIMETHYLAMINO-4,5,6,12A-TETRAHYDRO-4,12A-DIMETHYL-3-OXOBENZOXAZOLO-[2,3-B]-2,6A-DIAZA-3A-AZONIAPHENALENE;PERCHLORATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H27ClN4O8
InChI InChI=1S/C23H27N4O4.ClHO4/c1-6-30-22(29)16-13-25-20-15(12-11-14(2)26(20)21(16)28)19(24(4)5)27-17-9-7-8-10-18(17)31-23(25,27)3;2-1(3,4)5/h7-10,13-14H,6,11-12H2,1-5H3;(H,2,3,4,5)/q+1;/p-1
InChIKey HEGRAFAZAHENEA-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 522.942 g/mol
Solvent CDCl3:DMSO-D6
Source File Reference UWED25528