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(1-(ETHYLCARBOXAMIDO)-5-CHLORO-2-OXO-2,3,4,5-TETRAHYDRO-1H-BENZO-[E]-[1,4]-DIAZEPIN-3-YL)-CARBAMIC-ACID-TERT.-BUTYLESTER
SpectraBase Compound ID 5XHJfI5ZBlC
InChI InChI=1S/C16H19ClN4O4/c1-16(2,3)25-15(24)20-13-14(23)21(8-11(18)22)10-7-5-4-6-9(10)12(17)19-13/h4-7,13H,8H2,1-3H3,(H2,18,22)(H,20,24)
InChIKey WPGVKVPQXPFOLZ-UHFFFAOYSA-N
Mol Weight 366.81 g/mol
Molecular Formula C16H19ClN4O4
Exact Mass 366.109483 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BUc4T6r1Y3X
Name (1-(ETHYLCARBOXAMIDO)-5-CHLORO-2-OXO-2,3,4,5-TETRAHYDRO-1H-BENZO-[E]-[1,4]-DIAZEPIN-3-YL)-CARBAMIC-ACID-TERT.-BUTYLESTER
Compound Number 24
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H19ClN4O4
InChI InChI=1S/C16H19ClN4O4/c1-16(2,3)25-15(24)20-13-14(23)21(8-11(18)22)10-7-5-4-6-9(10)12(17)19-13/h4-7,13H,8H2,1-3H3,(H2,18,22)(H,20,24)
InChIKey WPGVKVPQXPFOLZ-UHFFFAOYSA-N
Literature Reference Author A.NADIN,J.M.S.LOPEZ,A.P.OWENS,D.M.HOWELLS,A.C.TALBOT,T.HARRI SON
Literature Reference Citation J.ORG.CHEM.,68,2844(2003)
Literature Reference DOI 10.1021/jo026860a
Molecular Weight 366.804 g/mol
Solvent DMSO
Source File Reference UWSI22735