| SpectraBase Compound ID | 6wr3VjUHCV3 |
|---|---|
| InChI | InChI=1S/C7H14N2OS/c1-8-3-5-10-6-4-9(2)7(8)11/h3-6H2,1-2H3 |
| InChIKey | MEHUHGANEVSWDC-UHFFFAOYSA-N |
| Mol Weight | 174.26 g/mol |
| Molecular Formula | C7H14N2OS |
| Exact Mass | 174.082684 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | LNCuM5Zas3w |
|---|---|
| Name | 4,6-Dimethyl-1-oxa-4,6-diazacyclooctane-5-thione |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 174.082684252 u |
| Formula | C7H14N2OS |
| InChI | InChI=1S/C7H14N2OS/c1-8-3-5-10-6-4-9(2)7(8)11/h3-6H2,1-2H3 |
| InChIKey | MEHUHGANEVSWDC-UHFFFAOYSA-N |
| Molecular Weight | 174.262 g/mol |
| SMILES | C1OCCN(C(N(C1)C)=S)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.813288 |