![1H-1,2,4-Triazole-1-ethanol, alpha-(1,1-dimethylethyl)-beta-[4-(4-fluorophenoxy)butyl]-alpha-1-propynyl-](/api/spectrum/AWMXBSCD2QQ/structure.png?h=300&w=458 "1H-1,2,4-Triazole-1-ethanol, alpha-(1,1-dimethylethyl)-beta-[4-(4-fluorophenoxy)butyl]-alpha-1-propynyl-")
| SpectraBase Compound ID | 7xpA0dpkWtx |
|---|---|
| InChI | InChI=1S/C21H28FN3O2/c1-5-13-21(26,20(2,3)4)19(25-16-23-15-24-25)8-6-7-14-27-18-11-9-17(22)10-12-18/h9-12,15-16,19,26H,6-8,14H2,1-4H3 |
| InChIKey | QLJRPGJFFBVAHU-UHFFFAOYSA-N |
| Mol Weight | 373.47 g/mol |
| Molecular Formula | C21H28FN3O2 |
| Exact Mass | 373.216555 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | AWMXBSCD2QQ |
|---|---|
| Name | 1H-1,2,4-Triazole-1-ethanol, alpha-(1,1-dimethylethyl)-beta-[4-(4-fluorophenoxy)butyl]-alpha-1-propynyl- |
| CAS Registry Number | 85812-64-2 |
| Copyright | Copyright © 1989, 1990-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C21H28FN3O2 |
| InChI | InChI=1S/C21H28FN3O2/c1-5-13-21(26,20(2,3)4)19(25-16-23-15-24-25)8-6-7-14-27-18-11-9-17(22)10-12-18/h9-12,15-16,19,26H,6-8,14H2,1-4H3 |
| InChIKey | QLJRPGJFFBVAHU-UHFFFAOYSA-N |
| Instrument Name | Bruker IFS 112 |
| Technique | KBr-Pellet |