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1-Butanone, 1-(5-methyl-1,3-dioxan-5-yl)-2-(1H-1,2,4-triazol-1-yl)-4-[2-(trifluoromethyl)phenoxy]-

View entire compound with spectra: 1 FTIR

1-Butanone, 1-(5-methyl-1,3-dioxan-5-yl)-2-(1H-1,2,4-triazol-1-yl)-4-[2-(trifluoromethyl)phenoxy]-
SpectraBase Compound ID CIFuVQ5p32h
InChI InChI=1S/C18H20F3N3O4/c1-17(8-26-12-27-9-17)16(25)14(24-11-22-10-23-24)6-7-28-15-5-3-2-4-13(15)18(19,20)21/h2-5,10-11,14H,6-9,12H2,1H3
InChIKey MGRJLKFABJPADP-UHFFFAOYSA-N
Mol Weight 399.37 g/mol
Molecular Formula C18H20F3N3O4
Exact Mass 399.140591 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID BeIzMEhIt91
Name 1-Butanone, 1-(5-methyl-1,3-dioxan-5-yl)-2-(1H-1,2,4-triazol-1-yl)-4-[2-(trifluoromethyl)phenoxy]-
CAS Registry Number 106574-75-8
Copyright Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H20F3N3O4
InChI InChI=1S/C18H20F3N3O4/c1-17(8-26-12-27-9-17)16(25)14(24-11-22-10-23-24)6-7-28-15-5-3-2-4-13(15)18(19,20)21/h2-5,10-11,14H,6-9,12H2,1H3
InChIKey MGRJLKFABJPADP-UHFFFAOYSA-N
Instrument Name Bruker IFS 85
Purity slightly contaminated
Technique Film