| SpectraBase Compound ID | Gmtt1KFCGfJ |
|---|---|
| InChI | InChI=1S/C9H14O2/c1-11-9-6-4-2-3-5-8(9)7-10/h7H,2-6H2,1H3 |
| InChIKey | KSBOXGGMZKFQGD-UHFFFAOYSA-N |
| Mol Weight | 154.21 g/mol |
| Molecular Formula | C9H14O2 |
| Exact Mass | 154.09938 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | HW41PMw1F4N |
|---|---|
| Name | 1-Cycloheptene-1-carboxaldehyde, 2-methoxy- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 154.099379689 u |
| Formula | C9H14O2 |
| InChI | InChI=1S/C9H14O2/c1-11-9-6-4-2-3-5-8(9)7-10/h7H,2-6H2,1H3 |
| InChIKey | KSBOXGGMZKFQGD-UHFFFAOYSA-N |
| Molecular Weight | 154.209 g/mol |
| SMILES | C1(=C(OC)CCCCC1)C=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.856949 |