| SpectraBase Compound ID | ErY0goVqtOr |
|---|---|
| InChI | InChI=1S/C6H12OS/c1-4-6(7)5(2)8-3/h5H,4H2,1-3H3/t5-/m1/s1 |
| InChIKey | LEAWVVZLYMZKTF-RXMQYKEDSA-N |
| Mol Weight | 132.22 g/mol |
| Molecular Formula | C6H12OS |
| Exact Mass | 132.060886 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | KVgrEzPgJKZ |
|---|---|
| Name | (R)-(+)-2-(methylsulfanyl)-3-pentanone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 132.060886179 u |
| Formula | C6H12OS |
| InChI | InChI=1S/C6H12OS/c1-4-6(7)5(2)8-3/h5H,4H2,1-3H3/t5-/m1/s1 |
| InChIKey | LEAWVVZLYMZKTF-RXMQYKEDSA-N |
| Molecular Weight | 132.221 g/mol |
| SMILES | C(=O)([C@](SC)(C)[H])CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.97992 |