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N-(TERT.-BUTYL)-9-CHLORO-4-(5-CHLOROTHIOPHENE-2-CARBONYL)-2-ISOBUTYL-6-METHYL-2,3,4,5-TETRAHYDROBENZO-[F]-[1,4]-OXAZEPINE-5-CARBOXAMIDE

View entire compound with spectra: 1 NMR

N-(TERT.-BUTYL)-9-CHLORO-4-(5-CHLOROTHIOPHENE-2-CARBONYL)-2-ISOBUTYL-6-METHYL-2,3,4,5-TETRAHYDROBENZO-[F]-[1,4]-OXAZEPINE-5-CARBOXAMIDE
SpectraBase Compound ID vMr7cdFQd6
InChI InChI=1S/C24H30Cl2N2O3S/c1-13(2)11-15-12-28(23(30)17-9-10-18(26)32-17)20(22(29)27-24(4,5)6)19-14(3)7-8-16(25)21(19)31-15/h7-10,13,15,20H,11-12H2,1-6H3,(H,27,29)/t15-,20-/m0/s1
InChIKey HAWUWFVWSBNIPQ-YWZLYKJASA-N
Mol Weight 497.48 g/mol
Molecular Formula C24H30Cl2N2O3S
Exact Mass 496.135419 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K9dEK4s9FZp
Name N-(TERT.-BUTYL)-9-CHLORO-4-(5-CHLOROTHIOPHENE-2-CARBONYL)-2-ISOBUTYL-6-METHYL-2,3,4,5-TETRAHYDROBENZO-[F]-[1,4]-OXAZEPINE-5-CARBOXAMIDE
Compound Number 14N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H30Cl2N2O3S
InChI InChI=1S/C24H30Cl2N2O3S/c1-13(2)11-15-12-28(23(30)17-9-10-18(26)32-17)20(22(29)27-24(4,5)6)19-14(3)7-8-16(25)21(19)31-15/h7-10,13,15,20H,11-12H2,1-6H3,(H,27,29)/t15-,20-/m0/s1
InChIKey HAWUWFVWSBNIPQ-YWZLYKJASA-N
Literature Reference Author L.BANFI,A.BAGNO,A.BASSO,C.D.SANTIS,R.RIVA,F.RASTRELLI
Literature Reference Citation EUR.J.ORG.CHEM.,2013,5064(2013)
Literature Reference DOI 10.1002/ejoc.201300541
Molecular Weight 497.480 g/mol
Solvent DMSO-D6
Source File Reference UWBT18269