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1-(2-Dimethylamino-ethyl)-6-phenyl-4H-S-triazolo(4,3-A)(1,4)benzodiazepine
SpectraBase Compound ID 3kyPygiqyLr
InChI InChI=1S/C20H21N5/c1-24(2)13-12-18-22-23-19-14-21-20(15-8-4-3-5-9-15)16-10-6-7-11-17(16)25(18)19/h3-11H,12-14H2,1-2H3
InChIKey YIBGSUCSGGBWFF-UHFFFAOYSA-N
Mol Weight 331.42 g/mol
Molecular Formula C20H21N5
Exact Mass 331.179696 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 85YU7fwazoZ
Name 1-(2-Dimethylamino-ethyl)-6-phenyl-4H-S-triazolo(4,3-A)(1,4)benzodiazepine
CAS Registry Number 72874-70-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H21N5
InChI InChI=1S/C20H21N5/c1-24(2)13-12-18-22-23-19-14-21-20(15-8-4-3-5-9-15)16-10-6-7-11-17(16)25(18)19/h3-11H,12-14H2,1-2H3
InChIKey YIBGSUCSGGBWFF-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