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2,2-Dimethyl-4-(1,2,4-triazolyl)-8-(2-fluorophenoxy)-3-octanone

View entire compound with spectra: 1 NMR, and 2 FTIR

2,2-Dimethyl-4-(1,2,4-triazolyl)-8-(2-fluorophenoxy)-3-octanone
SpectraBase Compound ID I2zGc9hSuJR
InChI InChI=1S/C18H24FN3O2/c1-18(2,3)17(23)15(22-13-20-12-21-22)9-6-7-11-24-16-10-5-4-8-14(16)19/h4-5,8,10,12-13,15H,6-7,9,11H2,1-3H3
InChIKey KLQCLUVSUADADU-UHFFFAOYSA-N
Mol Weight 333.41 g/mol
Molecular Formula C18H24FN3O2
Exact Mass 333.185255 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 55D9ldCSSAq
Name 2,2-Dimethyl-4-(1,2,4-triazolyl)-8-(2-fluorophenoxy)-3-octanone
CAS Registry Number 95354-18-0
Copyright Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H24FN3O2
InChI InChI=1S/C18H24FN3O2/c1-18(2,3)17(23)15(22-13-20-12-21-22)9-6-7-11-24-16-10-5-4-8-14(16)19/h4-5,8,10,12-13,15H,6-7,9,11H2,1-3H3
InChIKey KLQCLUVSUADADU-UHFFFAOYSA-N
Instrument Name Bruker IFS 85
Purity slightly contaminated
Synonyms 3-Octanone, 8-(2-fluorophenoxy)-2,2-dimethyl-4-(1H-1,2,4-triazol-1-yl)-
Technique Film