![Ethanamine, N-ethyl-N-[(ethylthio)methyl]-](/api/spectrum/2gmcUR6iFOL/structure.png?h=300&w=458 "Ethanamine, N-ethyl-N-[(ethylthio)methyl]-")
| SpectraBase Compound ID | C9ZGk8Q0OuL |
|---|---|
| InChI | InChI=1S/C7H17NS/c1-4-8(5-2)7-9-6-3/h4-7H2,1-3H3 |
| InChIKey | ICOIBUQDJVFIBX-UHFFFAOYSA-N |
| Mol Weight | 147.28 g/mol |
| Molecular Formula | C7H17NS |
| Exact Mass | 147.108171 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 2gmcUR6iFOL |
|---|---|
| Name | Ethanamine, N-ethyl-N-[(ethylthio)methyl]- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 147.108170725 u |
| Formula | C7H17NS |
| InChI | InChI=1S/C7H17NS/c1-4-8(5-2)7-9-6-3/h4-7H2,1-3H3 |
| InChIKey | ICOIBUQDJVFIBX-UHFFFAOYSA-N |
| Molecular Weight | 147.280 g/mol |
| SMILES | C(N(CC)CC)SCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.841538 |