![1H-1,2,4-Triazole-1-ethanol, beta-[4-(4-chloro-2-methylphenoxy)butyl]-alpha-(5-methyl-1,3-dioxan-5-yl)-](/api/spectrum/6kCP5z0JWWE/structure.png?h=300&w=458 "1H-1,2,4-Triazole-1-ethanol, beta-[4-(4-chloro-2-methylphenoxy)butyl]-alpha-(5-methyl-1,3-dioxan-5-yl)-")
| SpectraBase Compound ID | 4uCA8HSwaXI |
|---|---|
| InChI | InChI=1S/C20H28ClN3O4/c1-15-9-16(21)6-7-18(15)28-8-4-3-5-17(24-13-22-12-23-24)19(25)20(2)10-26-14-27-11-20/h6-7,9,12-13,17,19,25H,3-5,8,10-11,14H2,1-2H3 |
| InChIKey | WHEZXHXCDUHKRD-UHFFFAOYSA-N |
| Mol Weight | 409.91 g/mol |
| Molecular Formula | C20H28ClN3O4 |
| Exact Mass | 409.176834 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | 6kCP5z0JWWE |
|---|---|
| Name | 1H-1,2,4-Triazole-1-ethanol, beta-[4-(4-chloro-2-methylphenoxy)butyl]-alpha-(5-methyl-1,3-dioxan-5-yl)- |
| CAS Registry Number | 106607-66-3 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C20H28ClN3O4 |
| InChI | InChI=1S/C20H28ClN3O4/c1-15-9-16(21)6-7-18(15)28-8-4-3-5-17(24-13-22-12-23-24)19(25)20(2)10-26-14-27-11-20/h6-7,9,12-13,17,19,25H,3-5,8,10-11,14H2,1-2H3 |
| InChIKey | WHEZXHXCDUHKRD-UHFFFAOYSA-N |
| Instrument Name | Bruker IFS 85 |
| Purity | slightly contaminated |
| Technique | Film |