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8-Chloro-1-(4-methyl-piperazinyl)-6-phenyl-4H-S-triazolo(4,3-A)(1,4)benzodiazepine
SpectraBase Compound ID Kwct3gW1VrQ
InChI InChI=1S/C21H21ClN6/c1-26-9-11-27(12-10-26)21-25-24-19-14-23-20(15-5-3-2-4-6-15)17-13-16(22)7-8-18(17)28(19)21/h2-8,13H,9-12,14H2,1H3
InChIKey CDXVRKYAZPDCRX-UHFFFAOYSA-N
Mol Weight 392.89 g/mol
Molecular Formula C21H21ClN6
Exact Mass 392.151622 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I9vD91nIRy4
Name 8-CHLORO-1-(4-METHYLPIPERAZINYL)-6-PHENYL-4H-S-TRIAZOLO-[4,3-A]-[1,4]-BENZODIAZEPINE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H21ClN6
InChI InChI=1S/C21H21ClN6/c1-26-9-11-27(12-10-26)21-25-24-19-14-23-20(15-5-3-2-4-6-15)17-13-16(22)7-8-18(17)28(19)21/h2-8,13H,9-12,14H2,1H3
InChIKey CDXVRKYAZPDCRX-UHFFFAOYSA-N
Literature Reference Author T.A.SCAHILL,S.L.SMITH
Literature Reference Citation MAGN.RES.CHEM.,23,280(1985)
Literature Reference DOI 10.1002/mrc.1260230415
Molecular Weight 392.891 g/mol
Solvent CDCl3
Source File Reference UNIW15224