| SpectraBase Compound ID | Iskd7TvrkaH |
|---|---|
| InChI | InChI=1S/C9H17NO2/c1-6-7(2)8(10(3)4)9(11)12-5/h6-8H,1H2,2-5H3 |
| InChIKey | JDBBTHIUJJTHKT-UHFFFAOYSA-N |
| Mol Weight | 171.24 g/mol |
| Molecular Formula | C9H17NO2 |
| Exact Mass | 171.125929 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | EVFK13CDvzU |
|---|---|
| Name | 2-(Dimethylamino)-3-methyl-4-pentenoic acid methyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 171.125928789 u |
| Formula | C9H17NO2 |
| InChI | InChI=1S/C9H17NO2/c1-6-7(2)8(10(3)4)9(11)12-5/h6-8H,1H2,2-5H3 |
| InChIKey | JDBBTHIUJJTHKT-UHFFFAOYSA-N |
| Molecular Weight | 171.240 g/mol |
| SMILES | C(C(N(C)C)C(C=C)C)(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.815516 |