| SpectraBase Compound ID | A5pmsNFaMbQ |
|---|---|
| InChI | InChI=1S/C10H18N2S/c1-6-4-10(2,3)7-5-11-9(13)12-8(6)7/h6-8H,4-5H2,1-3H3,(H2,11,12,13) |
| InChIKey | OVXCYBKZAGGOKK-UHFFFAOYSA-N |
| Mol Weight | 198.33 g/mol |
| Molecular Formula | C10H18N2S |
| Exact Mass | 198.11907 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | FCvfVLCPPPo |
|---|---|
| Name | 2H-Cyclopentapyrimidine-2-thione, octahydro-5,5,7-trimethyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 198.119069762 u |
| Formula | C10H18N2S |
| InChI | InChI=1S/C10H18N2S/c1-6-4-10(2,3)7-5-11-9(13)12-8(6)7/h6-8H,4-5H2,1-3H3,(H2,11,12,13) |
| InChIKey | OVXCYBKZAGGOKK-UHFFFAOYSA-N |
| SMILES | N1C(NC2C(CC(C2C1)(C)C)C)=S |
| Spectrum/Structure Validation Score (Raman) | 0.974647 |