| SpectraBase Compound ID | DzNMz7IaPM9 |
|---|---|
| InChI | InChI=1S/C7H15N3S/c1-7(2,3)10-4-8-6(11)9-5-10/h4-5H2,1-3H3,(H2,8,9,11) |
| InChIKey | KFHMIFDHPDEVCW-UHFFFAOYSA-N |
| Mol Weight | 173.28 g/mol |
| Molecular Formula | C7H15N3S |
| Exact Mass | 173.098669 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 55y5sW0QhqX |
|---|---|
| Name | 5-Tert-butyltetrahydro-S-triazine-2(1H)-thione |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 173.098668669 u |
| Formula | C7H15N3S |
| InChI | InChI=1S/C7H15N3S/c1-7(2,3)10-4-8-6(11)9-5-10/h4-5H2,1-3H3,(H2,8,9,11) |
| InChIKey | KFHMIFDHPDEVCW-UHFFFAOYSA-N |
| Molecular Weight | 173.278 g/mol |
| SMILES | N1C(NCN(C1)C(C)(C)C)=S |
| Spectrum/Structure Validation Score (Raman) | 0.945072 |