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2-(2,4-dichlorophenyl)-2-[(1H-1,2,4-triazol-1-yl)methyl]-1,3-dioxolane-4-methanol

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2-(2,4-dichlorophenyl)-2-[(1H-1,2,4-triazol-1-yl)methyl]-1,3-dioxolane-4-methanol
SpectraBase Compound ID FwC0xMWvRK0
InChI InChI=1S/C13H13Cl2N3O3/c14-9-1-2-11(12(15)3-9)13(6-18-8-16-7-17-18)20-5-10(4-19)21-13/h1-3,7-8,10,19H,4-6H2/t10?,13-/m1/s1
InChIKey NKUOWQPBYUKRIM-JLOHTSLTSA-N
Mol Weight 330.17 g/mol
Molecular Formula C13H13Cl2N3O3
Exact Mass 329.033397 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID CRnXb3SvoW0
Name 2-(2,4-DICHLOROPHENYL)-2-[(1H-1,2,4-TRIAZOL-1-YL)METHYL]-1,3-DIOXOLANE-4-METHANOL
Source of Sample J. Heeres, Janssen Pharmaceutica, Beerse, Belgium
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13Cl2N3O3
InChI InChI=1S/C13H13Cl2N3O3/c14-9-1-2-11(12(15)3-9)13(6-18-8-16-7-17-18)20-5-10(4-19)21-13/h1-3,7-8,10,19H,4-6H2/t10?,13-/m1/s1
InChIKey NKUOWQPBYUKRIM-JLOHTSLTSA-N
Literature Reference J. MED. CHEM. 26, 611(1983) Abstract-Chemical Abstracts= 98, 125988H(1983)
Melting Point 138.2C
Molecular Weight 330.165009
Synonyms 1,3-DIOXOLANE-4-METHANOL, 2-/2,4-DI- CHLOROPHENYL/-2-//1H-1,2,4-TRIAZOL- 1-YL/METHYL/-,
Technique KBr WAFER