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1-(5-Methyl-1,3-dioxan-5-yl)-2-(1,2,4-triazolyl)-3-(4-trifluoro-phenyl)-propanol diast.A

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

1-(5-Methyl-1,3-dioxan-5-yl)-2-(1,2,4-triazolyl)-3-(4-trifluoro-phenyl)-propanol diast.A
SpectraBase Compound ID 4XbXKkAWndX
InChI InChI=1S/C17H20F3N3O3/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/h2-5,9-10,14-15,24H,6-8,11H2,1H3
InChIKey LRCMJMGSHXOTPD-UHFFFAOYSA-N
Mol Weight 371.36 g/mol
Molecular Formula C17H20F3N3O3
Exact Mass 371.145676 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 9VbW6Bn6fbN
Name 1-(5-Methyl-1,3-dioxan-5-yl)-2-(1,2,4-triazolyl)-3-(4-trifluorophenyl)propanol (diast. A)
CAS Registry Number 101769-66-8
Copyright Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H20F3N3O3
InChI InChI=1S/C17H20F3N3O3/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/h2-5,9-10,14-15,24H,6-8,11H2,1H3
InChIKey LRCMJMGSHXOTPD-UHFFFAOYSA-N
Instrument Name Bruker IFS 112
Synonyms 1H-1,2,4-Triazole-1-ethanol, alpha-(5-methyl-1,3-dioxan-5-yl)-beta-[[4-(trifluoromethyl)phenyl ]methyl]-
Technique KBr-Pellet