| SpectraBase Compound ID | 1T5qk9T8OT |
|---|---|
| InChI | InChI=1S/C7H13NOS/c1-5-4-7(2,3)8-6(10)9-5/h5H,4H2,1-3H3,(H,8,10) |
| InChIKey | JYHGFCBHXIDYOU-UHFFFAOYSA-N |
| Mol Weight | 159.25 g/mol |
| Molecular Formula | C7H13NOS |
| Exact Mass | 159.071785 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | G5q2krbodU6 |
|---|---|
| Name | 4,4,6-Trimethyl-5,6-dihydro-(4H)-1,3-oxazine-2-thiol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 159.071785216 u |
| Formula | C7H13NOS |
| InChI | InChI=1S/C7H13NOS/c1-5-4-7(2,3)8-6(10)9-5/h5H,4H2,1-3H3,(H,8,10) |
| InChIKey | JYHGFCBHXIDYOU-UHFFFAOYSA-N |
| Molecular Weight | 159.247 g/mol |
| SMILES | SC1=NC(CC(O1)C)(C)C |
| Spectrum/Structure Validation Score (Raman) | 0.817971 |