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4,4-Dimethyl-1-(2,4-dichloro-phenyl)-2-(1,2,4-triazolyl)-3-pentanone

View entire compound with spectra: 1 NMR, and 1 FTIR

4,4-Dimethyl-1-(2,4-dichloro-phenyl)-2-(1,2,4-triazolyl)-3-pentanone
SpectraBase Compound ID BRqdkvk30YE
InChI InChI=1S/C15H17Cl2N3O/c1-15(2,3)14(21)13(20-9-18-8-19-20)6-10-4-5-11(16)7-12(10)17/h4-5,7-9,13H,6H2,1-3H3
InChIKey NSLVZQNHOCYSEE-UHFFFAOYSA-N
Mol Weight 326.23 g/mol
Molecular Formula C15H17Cl2N3O
Exact Mass 325.074868 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID BsOo0zSZepB
Name 3-Pentanone, 1-(2,4-dichlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)-
CAS Registry Number 63191-09-3
Copyright Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C15H17Cl2N3O
InChI InChI=1S/C15H17Cl2N3O/c1-15(2,3)14(21)13(20-9-18-8-19-20)6-10-4-5-11(16)7-12(10)17/h4-5,7-9,13H,6H2,1-3H3
InChIKey NSLVZQNHOCYSEE-UHFFFAOYSA-N
Instrument Name Bruker IFS 85
Purity slightly contaminated
Synonyms 4,4-Dimethyl-1-(2,4-dichlorophenyl)-2-(1,2,4-triazolyl)-3-pentanone
Technique KBr-Pellet