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8-Chloro-1-methoxy-6-phenyl-4H-S-triazolo(4,3-A)(1,4)benzodiazepine
SpectraBase Compound ID 7unJm6Msme6
InChI InChI=1S/C17H13ClN4O/c1-23-17-21-20-15-10-19-16(11-5-3-2-4-6-11)13-9-12(18)7-8-14(13)22(15)17/h2-9H,10H2,1H3
InChIKey YUOQRJNUOYAPPV-UHFFFAOYSA-N
Mol Weight 324.77 g/mol
Molecular Formula C17H13ClN4O
Exact Mass 324.077789 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H05COwCMI60
Name 8-Chloro-1-methoxy-6-phenyl-4H-S-triazolo(4,3-A)(1,4)benzodiazepine
CAS Registry Number 39667-63-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H13ClN4O
InChI InChI=1S/C17H13ClN4O/c1-23-17-21-20-15-10-19-16(11-5-3-2-4-6-11)13-9-12(18)7-8-14(13)22(15)17/h2-9H,10H2,1H3
InChIKey YUOQRJNUOYAPPV-UHFFFAOYSA-N
Instrument Name Varian XL-200
Literature Reference T.A. Scahill, S.L. Smith, Magn. Res. Chem. 23, 280 (1985).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3