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(1-METHYL-2,5-DIOXO-2,3,4,5-TETRAHYDRO-1H-BENZO-[E]-[1,4]-DIAZEPIN-3-YL)-CARBAMIC-ACID-BENZYLESTER
SpectraBase Compound ID Gq4R4phOB4o
InChI InChI=1S/C18H17N3O4/c1-21-14-10-6-5-9-13(14)16(22)19-15(17(21)23)20-18(24)25-11-12-7-3-2-4-8-12/h2-10,15H,11H2,1H3,(H,19,22)(H,20,24)
InChIKey VYPQMWTYUVMNMV-UHFFFAOYSA-N
Mol Weight 339.35 g/mol
Molecular Formula C18H17N3O4
Exact Mass 339.121906 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FzU4sk3waIC
Name (1-METHYL-2,5-DIOXO-2,3,4,5-TETRAHYDRO-1H-BENZO-[E]-[1,4]-DIAZEPIN-3-YL)-CARBAMIC-ACID-BENZYLESTER
Compound Number 19
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H17N3O4
InChI InChI=1S/C18H17N3O4/c1-21-14-10-6-5-9-13(14)16(22)19-15(17(21)23)20-18(24)25-11-12-7-3-2-4-8-12/h2-10,15H,11H2,1H3,(H,19,22)(H,20,24)
InChIKey VYPQMWTYUVMNMV-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 339.351 g/mol
Solvent DMSO
Source File Reference UWSI22731