SpectraBase Compound ID | C63Ip5M6LFT |
---|---|
InChI | InChI=1S/C10H22O/c1-4-6-7-8-10(11)9(3)5-2/h9-11H,4-8H2,1-3H3 |
InChIKey | SWZLKUVKOMLFMU-UHFFFAOYSA-N |
Mol Weight | 158.28 g/mol |
Molecular Formula | C10H22O |
Exact Mass | 158.167065 g/mol |
SpectraBase Spectrum ID | 4R2wz9538j6 |
---|---|
Name | 3-Methyl-4-nonanol |
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/c1-4-6-7-8-10(11)9(3)5-2/h9-11H,4-8H2,1-3H3 |
InChIKey | SWZLKUVKOMLFMU-UHFFFAOYSA-N |
Molecular Weight | 158.285 g/mol |
SMILES | OC(CCCCC)C(CC)C |
Spectrum/Structure Validation Score (Raman) | 0.973744 |