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5,6-DIHYDRO-5-METHYL-3-NITRO-12-(H)-BENZOFURO-[3.2-B]-[1.5]-BENZODIAZEPIN-6-ONE
SpectraBase Compound ID KBGWhu7yJNR
InChI InChI=1S/C16H11N3O4/c1-18-12-8-9(19(21)22)6-7-11(12)17-14-10-4-2-3-5-13(10)23-15(14)16(18)20/h2-8,17H,1H3
InChIKey VVYCCYVRCOPBNU-UHFFFAOYSA-N
Mol Weight 309.28 g/mol
Molecular Formula C16H11N3O4
Exact Mass 309.074956 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7ftxcCjihjm
Name 5,6-DIHYDRO-5-METHYL-3-NITRO-12-(H)-BENZOFURO-[3.2-B]-[1.5]-BENZODIAZEPIN-6-ONE
Compound Number 5E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H11N3O4
InChI InChI=1S/C16H11N3O4/c1-18-12-8-9(19(21)22)6-7-11(12)17-14-10-4-2-3-5-13(10)23-15(14)16(18)20/h2-8,17H,1H3
InChIKey VVYCCYVRCOPBNU-UHFFFAOYSA-N
Literature Reference Author G.VITI,D.GIANNOTTI,R.NANNICINI,R.RICCI,V.PESTELLINI
Literature Reference Citation J.HETCYCL.CHEM.,27,1369(1990)
Literature Reference DOI 10.1002/jhet.5570270535
Molecular Weight 309.281 g/mol
Solvent DMSO-D6
Source File Reference UWMZ1025