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FDUKWPWJJAHWEU-UHFFFAOYSA-N
SpectraBase Compound ID 2pwExvsoefI
InChI InChI=1S/C17H12Cl2N4O/c18-10-5-6-14-12(7-10)17(11-3-1-2-4-13(11)19)20-8-15-21-22-16(24)9-23(14)15/h1-7H,8-9H2,(H,22,24)
InChIKey FDUKWPWJJAHWEU-UHFFFAOYSA-N
Mol Weight 359.22 g/mol
Molecular Formula C17H12Cl2N4O
Exact Mass 358.038816 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EOa6E46Kvn1
Name 9-Chloro-7-(2-chloro-phenyl)-3,5-dihydro-aS-triazino(4,3-A)(1,4)benzodiazepin-2(1H)-one
CAS Registry Number 49614-12-2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H12Cl2N4O
InChI InChI=1S/C17H12Cl2N4O/c18-10-5-6-14-12(7-10)17(11-3-1-2-4-13(11)19)20-8-15-21-22-16(24)9-23(14)15/h1-7H,8-9H2,(H,22,24)
InChIKey FDUKWPWJJAHWEU-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