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1-(5-Methyl-1,3-dioxan-5-yl)-2-(1,2,4-triazolyl)-6-(2-fluoro-phenoxy)-1-hexanone

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

1-(5-Methyl-1,3-dioxan-5-yl)-2-(1,2,4-triazolyl)-6-(2-fluoro-phenoxy)-1-hexanone
SpectraBase Compound ID L1BJXDq3hns
InChI InChI=1S/C19H24FN3O4/c1-19(10-25-14-26-11-19)18(24)16(23-13-21-12-22-23)7-4-5-9-27-17-8-3-2-6-15(17)20/h2-3,6,8,12-13,16H,4-5,7,9-11,14H2,1H3
InChIKey VLZGRNWHLGNQTG-UHFFFAOYSA-N
Mol Weight 377.42 g/mol
Molecular Formula C19H24FN3O4
Exact Mass 377.175084 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID KP1vgrwAimW
Name 1-(5-Methyl-1,3-dioxan-5-yl)-2-(1,2,4-triazolyl)-6-(2-fluorophenoxy)-1-hexanone
CAS Registry Number 106558-69-4
Copyright Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C19H24FN3O4
InChI InChI=1S/C19H24FN3O4/c1-19(10-25-14-26-11-19)18(24)16(23-13-21-12-22-23)7-4-5-9-27-17-8-3-2-6-15(17)20/h2-3,6,8,12-13,16H,4-5,7,9-11,14H2,1H3
InChIKey VLZGRNWHLGNQTG-UHFFFAOYSA-N
Instrument Name Bruker IFS 85
Purity slightly contaminated
Synonyms 1-Hexanone, 6-(2-fluorophenoxy)-1-(5-methyl-1,3-dioxan-5-yl)-2-(1H-1,2,4-triazol-1-yl)-
Technique KBr-Pellet