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N-(TERT.-BUTYL)-9-CHLORO-4-(5-CHLOROTHIOPHENE-2-CARBONYL)-2-ISOBUTYL-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-2,3,4,5-TETRAHYDROBENZO-[F]-[1,4]-OXAZEPINE-5-CARBOXAMIDE
SpectraBase Compound ID 9xizh0tJK9L
InChI InChI=1S/C23H28Cl2N2O3S/c1-13(2)11-14-12-27(22(29)17-9-10-18(25)31-17)19(21(28)26-23(3,4)5)15-7-6-8-16(24)20(15)30-14/h6-10,13-14,19H,11-12H2,1-5H3,(H,26,28)/t14-,19-/m0/s1
InChIKey WEPKTESIXVCPJP-LIRRHRJNSA-N
Mol Weight 483.45 g/mol
Molecular Formula C23H28Cl2N2O3S
Exact Mass 482.119769 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CjZprHX0mEJ
Name N-(TERT.-BUTYL)-9-CHLORO-4-(5-CHLOROTHIOPHENE-2-CARBONYL)-2-ISOBUTYL-2,3,4,5-TETRAHYDROBENZO-[F]-[1,4]-OXAZEPINE-5-CARBOXAMIDE
Compound Number 14J
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H28Cl2N2O3S
InChI InChI=1S/C23H28Cl2N2O3S/c1-13(2)11-14-12-27(22(29)17-9-10-18(25)31-17)19(21(28)26-23(3,4)5)15-7-6-8-16(24)20(15)30-14/h6-10,13-14,19H,11-12H2,1-5H3,(H,26,28)/t14-,19-/m0/s1
InChIKey WEPKTESIXVCPJP-LIRRHRJNSA-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 483.453 g/mol
Solvent DMSO-D6
Source File Reference UWBT18245