![1-[N-Aziridyl]-2-methyl-2-propanethiol](/api/spectrum/GuoVRtVyMy2/structure.png?h=300&w=458 "1-[N-Aziridyl]-2-methyl-2-propanethiol")
| SpectraBase Compound ID | H4fEXTVhoZU |
|---|---|
| InChI | InChI=1S/C6H13NS/c1-6(2,8)5-7-3-4-7/h8H,3-5H2,1-2H3 |
| InChIKey | PJWGLZVOOFENOL-UHFFFAOYSA-N |
| Mol Weight | 131.24 g/mol |
| Molecular Formula | C6H13NS |
| Exact Mass | 131.076871 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | GuoVRtVyMy2 |
|---|---|
| Name | 1-[N-Aziridyl]-2-methyl-2-propanethiol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 131.076870597 u |
| Formula | C6H13NS |
| InChI | InChI=1S/C6H13NS/c1-6(2,8)5-7-3-4-7/h8H,3-5H2,1-2H3 |
| InChIKey | PJWGLZVOOFENOL-UHFFFAOYSA-N |
| SMILES | CC(S)(C)CN1CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.909525 |