| SpectraBase Compound ID | LQKXKbImhZE |
|---|---|
| InChI | InChI=1S/C9H19NO3/c1-4-5-7-12-9(11)13-8-6-10(2)3/h4-8H2,1-3H3 |
| InChIKey | DSTYFBTUNPKPAA-UHFFFAOYSA-N |
| Mol Weight | 189.25 g/mol |
| Molecular Formula | C9H19NO3 |
| Exact Mass | 189.136493 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | IM4pHPxTObD |
|---|---|
| Name | Carbonic acid, butyl 2-dimethylaminoethyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 189.136493473 u |
| Formula | C9H19NO3 |
| InChI | InChI=1S/C9H19NO3/c1-4-5-7-12-9(11)13-8-6-10(2)3/h4-8H2,1-3H3 |
| InChIKey | DSTYFBTUNPKPAA-UHFFFAOYSA-N |
| Molecular Weight | 189.255 g/mol |
| SMILES | C(OCCCC)(=O)OCCN(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.961549 |