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2-Propen-1-one, 1-(5-methyl-1,3-dioxan-5-yl)-2-(1H-1,2,4-triazol-1-yl)-3-[4-(trifluoromethyl)phenyl]-

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

2-Propen-1-one, 1-(5-methyl-1,3-dioxan-5-yl)-2-(1H-1,2,4-triazol-1-yl)-3-[4-(trifluoromethyl)phenyl]-
SpectraBase Compound ID CorvnfkvClM
InChI InChI=1S/C17H16F3N3O3/c1-16(7-25-11-26-8-16)15(24)14(23-10-21-9-22-23)6-12-2-4-13(5-3-12)17(18,19)20/h2-6,9-10H,7-8,11H2,1H3/b14-6-
InChIKey XUGVPPNLSSUYSA-NSIKDUERSA-N
Mol Weight 367.33 g/mol
Molecular Formula C17H16F3N3O3
Exact Mass 367.114376 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID LqOkX7DHkpW
Name 2-Propen-1-one, 1-(5-methyl-1,3-dioxan-5-yl)-2-(1H-1,2,4-triazol-1-yl)-3-[4-(trifluoromethyl)phenyl]-
CAS Registry Number 81304-50-9
Copyright Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H16F3N3O3
InChI InChI=1S/C17H16F3N3O3/c1-16(7-25-11-26-8-16)15(24)14(23-10-21-9-22-23)6-12-2-4-13(5-3-12)17(18,19)20/h2-6,9-10H,7-8,11H2,1H3/b14-6-
InChIKey XUGVPPNLSSUYSA-NSIKDUERSA-N
Instrument Name Bruker IFS 85
Purity slightly contaminated
Technique Film