| SpectraBase Compound ID | EDVsVi1FkdK |
|---|---|
| InChI | InChI=1S/C11H24O/c1-10(2,3)9(7-8-12)11(4,5)6/h9,12H,7-8H2,1-6H3 |
| InChIKey | GPYFYNLFZTYJCE-UHFFFAOYSA-N |
| Mol Weight | 172.31 g/mol |
| Molecular Formula | C11H24O |
| Exact Mass | 172.182715 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | ClSErfZOJ56 |
|---|---|
| Name | 3-Tert-butyl-4,4-dimethyl-1-pentanol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 172.182715392 u |
| Formula | C11H24O |
| InChI | InChI=1S/C11H24O/c1-10(2,3)9(7-8-12)11(4,5)6/h9,12H,7-8H2,1-6H3 |
| InChIKey | GPYFYNLFZTYJCE-UHFFFAOYSA-N |
| Molecular Weight | 172.312 g/mol |
| SMILES | C(C(C)(C)C)(C(C)(C)C)CCO |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.939226 |