| SpectraBase Compound ID | J2nQ7jKT87b |
|---|---|
| InChI | InChI=1S/C10H22O/c1-4-7-10(11,8-5-2)9-6-3/h11H,4-9H2,1-3H3 |
| InChIKey | SJTPBRMACCDJPZ-UHFFFAOYSA-N |
| Mol Weight | 158.28 g/mol |
| Molecular Formula | C10H22O |
| Exact Mass | 158.167065 g/mol |
Raman Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 2KKt6AoHaN6 |
|---|---|
| Name | 4-Propyl-4-heptanol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 158.167065327 u |
| Formula | C10H22O |
| InChI | InChI=1S/C10H22O/c1-4-7-10(11,8-5-2)9-6-3/h11H,4-9H2,1-3H3 |
| InChIKey | SJTPBRMACCDJPZ-UHFFFAOYSA-N |
| Molecular Weight | 158.285 g/mol |
| SMILES | OC(CCC)(CCC)CCC |
| Spectrum/Structure Validation Score (Raman) | 0.958615 |