![3-[(2-Methoxyethyl)amino]propanenitrile, N-acetyl-](/api/spectrum/C4tBhQRxsLc/structure.png?h=300&w=458 "3-[(2-Methoxyethyl)amino]propanenitrile, N-acetyl-")
| SpectraBase Compound ID | 9bRsU47fj1K |
|---|---|
| InChI | InChI=1S/C8H14N2O2/c1-8(11)10(5-3-4-9)6-7-12-2/h3,5-7H2,1-2H3 |
| InChIKey | ZQDMTGNTKKZQMF-UHFFFAOYSA-N |
| Mol Weight | 170.21 g/mol |
| Molecular Formula | C8H14N2O2 |
| Exact Mass | 170.105528 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | C4tBhQRxsLc |
|---|---|
| Name | 3-[(2-Methoxyethyl)amino]propanenitrile, N-acetyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 170.105527697 u |
| Formula | C8H14N2O2 |
| InChI | InChI=1S/C8H14N2O2/c1-8(11)10(5-3-4-9)6-7-12-2/h3,5-7H2,1-2H3 |
| InChIKey | ZQDMTGNTKKZQMF-UHFFFAOYSA-N |
| Molecular Weight | 170.212 g/mol |
| SMILES | C(N(CCC#N)C(C)=O)COC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.959755 |