| SpectraBase Compound ID | AUNlwA6r0XS |
|---|---|
| InChI | InChI=1S/C11H24O/c1-4-7-8-9-11(12)10(5-2)6-3/h10-12H,4-9H2,1-3H3 |
| InChIKey | XPXGPUFPGMFVJX-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 | 5uVJ4KMDj1U |
|---|---|
| Name | 3-Ethyl-4-nonanol |
| 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/c1-4-7-8-9-11(12)10(5-2)6-3/h10-12H,4-9H2,1-3H3 |
| InChIKey | XPXGPUFPGMFVJX-UHFFFAOYSA-N |
| Molecular Weight | 172.312 g/mol |
| SMILES | C(C)CCCC(O)C(CC)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.934534 |