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1-bromo-8-chloro-4-methyl-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine
SpectraBase Compound ID AklK1krLdTt
InChI InChI=1S/C17H12BrClN4/c1-10-16-21-22-17(18)23(16)14-8-7-12(19)9-13(14)15(20-10)11-5-3-2-4-6-11/h2-10H,1H3
InChIKey VUCWPORAJVYUHK-UHFFFAOYSA-N
Mol Weight 387.67 g/mol
Molecular Formula C17H12BrClN4
Exact Mass 385.993387 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3VreQjJWbzN
Name 1-bromo-8-chloro-4-methyl-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine
Compound Number 20
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H12BrClN4
InChI InChI=1S/C17H12BrClN4/c1-10-16-21-22-17(18)23(16)14-8-7-12(19)9-13(14)15(20-10)11-5-3-2-4-6-11/h2-10H,1H3
InChIKey VUCWPORAJVYUHK-UHFFFAOYSA-N
Literature Reference Author T.A.SCAHILL,S.L.SMITH
Literature Reference Citation ORG.MAGN.RES.,21,662(1983)
Literature Reference DOI 10.1002/omr.1270211104
Solvent CDCl3;CR(ACAC)3
Source File Reference UWED16538