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2-CHLORO-7-ETHOXYCARBONYLMETHYL-9A,10,11,12,12A,12B-HEXAHYDRO-11-METHYL-7H,10,12-DIOXOPYRROLO-[3',4':4,5]-ISOXAZOLO-[2,3-D]-[1,4]-BENZODIAZEPIN-

Compound with spectra: 1 NMR

2-CHLORO-7-ETHOXYCARBONYLMETHYL-9A,10,11,12,12A,12B-HEXAHYDRO-11-METHYL-7H,10,12-DIOXOPYRROLO-[3',4':4,5]-ISOXAZOLO-[2,3-D]-[1,4]-BENZODIAZEPIN-
SpectraBase Compound ID 5DxZHvwvYqF
InChI InChI=1S/C18H18ClN3O6/c1-3-27-12(23)7-11-16(24)20-10-5-4-8(19)6-9(10)14-13-15(28-22(11)14)18(26)21(2)17(13)25/h4-6,11,13-15H,3,7H2,1-2H3,(H,20,24)/t11-,13+,14-,15-/m0/s1
InChIKey GGPJPXITZPPWRG-ATGSNQNLSA-N
Mol Weight 407.81 g/mol
Molecular Formula C18H18ClN3O6
Exact Mass 407.088413 g/mol
Enantiomer InChIKey GGPJPXITZPPWRG-FAAHXZRKSA-N

View Spectrum of 2-CHLORO-7-ETHOXYCARBONYLMETHYL-9A,10,11,12,12A,12B-HEXAHYDRO-11-METHYL-7H,10,12-DIOXOPYRROLO-[3',4':4,5]-ISOXAZOLO-[2,3-D]-[1,4]-BENZODIAZEPIN-

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Title Journal or Book Year
Nitrogen containing heterocycles from aldoximes; a one-pot route to isoxazolobenzodiazepinones, N-substituted and N-unsubstituted isoxazoloquinolinones Journal of the Chemical Society, Perkin Transactions 1 1998
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