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3-(4-CHLOROBENZYL)-4-HYDROXY-4,5-DIHYDRO-1,2,4-TRIAZOL-5-ONE

View entire compound with spectra: 1 NMR

3-(4-CHLOROBENZYL)-4-HYDROXY-4,5-DIHYDRO-1,2,4-TRIAZOL-5-ONE
SpectraBase Compound ID HKwzSvVoMMt
InChI InChI=1S/C9H8ClN3O2/c10-7-3-1-6(2-4-7)5-8-11-12-9(14)13(8)15/h1-4,15H,5H2,(H,12,14)
InChIKey KVINILXXNJBRJB-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 1RlONh7vn1B
Name 3-(4-CHLOROBENZYL)-4-HYDROXY-4,5-DIHYDRO-1,2,4-TRIAZOL-5-ONE
Compound Number 2E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H7ClN3O2
InChI InChI=1S/C9H8ClN3O2/c10-7-3-1-6(2-4-7)5-8-11-12-9(14)13(8)15/h1-4,15H,5H2,(H,12,14)
InChIKey KVINILXXNJBRJB-UHFFFAOYSA-N
Literature Reference Author A.A.IKIZLER,K.SANCAK
Literature Reference Citation MH.CHEM.,123,257(1992)
Literature Reference DOI 10.1007/BF00810474
Molecular Weight 224.626 g/mol
Solvent DMSO-D6
Source File Reference UWCS21200