| SpectraBase Compound ID | B57dtA7WVRZ |
|---|---|
| InChI | InChI=1S/C8H12O2/c9-6-7-2-1-3-8(10-7)4-5-8/h6-7H,1-5H2 |
| InChIKey | MEVJMOHPSRDJMH-UHFFFAOYSA-N |
| Mol Weight | 140.18 g/mol |
| Molecular Formula | C8H12O2 |
| Exact Mass | 140.08373 g/mol |
| SpectraBase Spectrum ID | CC7aZfGUWC5 |
|---|---|
| Name | 1-oxa-Spiro[5.2]octane-2-carbaldehyde |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 140.083729624 u |
| Formula | C8H12O2 |
| InChI | InChI=1S/C8H12O2/c9-6-7-2-1-3-8(10-7)4-5-8/h6-7H,1-5H2 |
| InChIKey | MEVJMOHPSRDJMH-UHFFFAOYSA-N |
| SMILES | C12(OC(C=O)CCC2)CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.889938 |