SpectraBase Compound ID | LTgB0qYaOeQ |
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InChI | InChI=1S/C8H14N2S/c1-2-5-10(6-3-1)8-9-4-7-11-8/h1-7H2 |
InChIKey | CYTVJMKDTUSULK-UHFFFAOYSA-N |
Mol Weight | 170.27 g/mol |
Molecular Formula | C8H14N2S |
Exact Mass | 170.08777 g/mol |
SpectraBase Spectrum ID | 4CKVXd6KhQ9 |
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Name | 2-Piperidino-2-thiazoline |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 170.087769633 u |
Formula | C8H14N2S |
InChI | InChI=1S/C8H14N2S/c1-2-5-10(6-3-1)8-9-4-7-11-8/h1-7H2 |
InChIKey | CYTVJMKDTUSULK-UHFFFAOYSA-N |
Molecular Weight | 170.274 g/mol |
SMILES | C1N(CCCC1)C1=NCCS1 |
Spectrum/Structure Validation Score (Raman) | 0.941244 |