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2-(3'-Chlorphenyl)-5-methoxy-1,2,4-triazolin-3-one
SpectraBase Compound ID GFxmQpPXMgv
InChI InChI=1S/C9H8ClN3O2/c1-15-8-11-9(14)13(12-8)7-4-2-3-6(10)5-7/h2-5H,1H3,(H,11,12,14)
InChIKey FKSCNTGJQXQTGD-UHFFFAOYSA-N
Mol Weight 225.63 g/mol
Molecular Formula C9H8ClN3O2
Exact Mass 225.030504 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KJXF4K47A2I
Name 2-(3'-Chlorphenyl)-5-methoxy-1,2,4-triazolin-3-one
CAS Registry Number 81012-75-1
Comments broad-band decoupling (BB)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H8ClN3O2
InChI InChI=1S/C9H8ClN3O2/c1-15-8-11-9(14)13(12-8)7-4-2-3-6(10)5-7/h2-5H,1H3,(H,11,12,14)
InChIKey FKSCNTGJQXQTGD-UHFFFAOYSA-N
Instrument Name SF = 080 MHz
Literature Reference J. Org. Chem. 47, 1969 (1982).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6