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4-(3-CHLORO-4-METHOXYPHENYL)-delta2-1,2,4-TRIAZOLIN-5-ONE
SpectraBase Compound ID AiymG9xUD5j
InChI InChI=1S/C9H8ClN3O2/c1-15-8-3-2-6(4-7(8)10)13-5-11-12-9(13)14/h2-5H,1H3,(H,12,14)
InChIKey ZSRBVDYFDBBVMI-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 At3AMfLLici
Name 4-(3-CHLORO-4-METHOXYPHENYL)-delta2-1,2,4-TRIAZOLIN-5-ONE
Source of Sample R. Rupprecht, W. Bremser BASF Ludwigshafen (1980)
CAS Registry Number 80240-43-3
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8ClN3O2
InChI InChI=1S/C9H8ClN3O2/c1-15-8-3-2-6(4-7(8)10)13-5-11-12-9(13)14/h2-5H,1H3,(H,12,14)
InChIKey ZSRBVDYFDBBVMI-UHFFFAOYSA-N
Molecular Weight 225.64
Solvent Polysol; Reference=TMS; Temperature=Ambient Spectrometer= Bruker WP-80
Synonyms TRIAZOLIN-5-ONE, D<2-1,2,4-, 4-/3-CHLORO-4-METHOXYPHENYL/-,