| SpectraBase Compound ID | GA8gtBlneT0 |
|---|---|
| InChI | InChI=1S/C7H12N2S/c10-7-8-4-5-2-1-3-6(5)9-7/h5-6H,1-4H2,(H2,8,9,10) |
| InChIKey | LTPWXPXNKXNETK-UHFFFAOYSA-N |
| Mol Weight | 156.25 g/mol |
| Molecular Formula | C7H12N2S |
| Exact Mass | 156.07212 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | LaOeuAFxu0Z |
|---|---|
| Name | 1,3,4,5,6,7-Hexahydro-2H-cyclopentapyrimidine-2-thione |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 156.072119568 u |
| Formula | C7H12N2S |
| InChI | InChI=1S/C7H12N2S/c10-7-8-4-5-2-1-3-6(5)9-7/h5-6H,1-4H2,(H2,8,9,10) |
| InChIKey | LTPWXPXNKXNETK-UHFFFAOYSA-N |
| Molecular Weight | 156.247 g/mol |
| SMILES | N1C(NC2CCCC2C1)=S |
| Spectrum/Structure Validation Score (Raman) | 0.752378 |