SpectraBase Compound ID | IDQYWyYJGPu |
---|---|
InChI | InChI=1S/C9H20N4S/c1-3-12(4-2)5-6-13-7-10-9(14)11-8-13/h3-8H2,1-2H3,(H2,10,11,14) |
InChIKey | SFWYITXKQNSUBC-UHFFFAOYSA-N |
Mol Weight | 216.35 g/mol |
Molecular Formula | C9H20N4S |
Exact Mass | 216.140868 g/mol |
SpectraBase Spectrum ID | 1RIz5Sau6pd |
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Name | 5-[2-(Diethylamino)ethyl]tetrahydro-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 | 216.140867834 u |
Formula | C9H20N4S |
InChI | InChI=1S/C9H20N4S/c1-3-12(4-2)5-6-13-7-10-9(14)11-8-13/h3-8H2,1-2H3,(H2,10,11,14) |
InChIKey | SFWYITXKQNSUBC-UHFFFAOYSA-N |
SMILES | N1C(NCN(C1)CCN(CC)CC)=S |
Spectrum/Structure Validation Score (Raman) | 0.904697 |