| SpectraBase Compound ID | GnKo8l5VM7H |
|---|---|
| InChI | InChI=1S/C7H16S/c1-4-5-8-6-7(2)3/h7H,4-6H2,1-3H3 |
| InChIKey | YZCUJPLKGSDCFP-UHFFFAOYSA-N |
| Mol Weight | 132.26 g/mol |
| Molecular Formula | C7H16S |
| Exact Mass | 132.097272 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | AMPM20dVv0F |
|---|---|
| Name | Isobutyl propyl sulfide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 132.097271689 u |
| Formula | C7H16S |
| InChI | InChI=1S/C7H16S/c1-4-5-8-6-7(2)3/h7H,4-6H2,1-3H3 |
| InChIKey | YZCUJPLKGSDCFP-UHFFFAOYSA-N |
| SMILES | CC(CSCCC)C |
| Spectrum/Structure Validation Score (Raman) | 0.938382 |