| SpectraBase Compound ID | FHIFaY3fIlt |
|---|---|
| InChI | InChI=1S/C10H11NO3/c1-7(13)14-9-3-4-10(11-2)8(5-9)6-12/h3-6,11H,1-2H3 |
| InChIKey | WPHJUDZICAMJFY-UHFFFAOYSA-N |
| Mol Weight | 193.2 g/mol |
| Molecular Formula | C10H11NO3 |
| Exact Mass | 193.073893 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 8oC5aGStesA |
|---|---|
| Name | Benzaldehyde, 5-(acetyloxy)-2-(methylamino)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 193.073893215 u |
| Formula | C10H11NO3 |
| InChI | InChI=1S/C10H11NO3/c1-7(13)14-9-3-4-10(11-2)8(5-9)6-12/h3-6,11H,1-2H3 |
| InChIKey | WPHJUDZICAMJFY-UHFFFAOYSA-N |
| Molecular Weight | 193.202 g/mol |
| SMILES | C=1(C(=CC=C(OC(=O)C)C1)NC)C=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.841562 |