| SpectraBase Compound ID | GXOeVXtrZve |
|---|---|
| InChI | InChI=1S/C11H16O2/c1-9-4-6-10(7-5-9)8-11(12-2)13-3/h4-7,11H,8H2,1-3H3 |
| InChIKey | BQTOTVBOOGPLPR-UHFFFAOYSA-N |
| Mol Weight | 180.25 g/mol |
| Molecular Formula | C11H16O2 |
| Exact Mass | 180.11503 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | JMp4X3qdLo5 |
|---|---|
| Name | 4-Methylphenylacetaldehyde dimethyl acetal |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 180.115029753 u |
| Formula | C11H16O2 |
| InChI | InChI=1S/C11H16O2/c1-9-4-6-10(7-5-9)8-11(12-2)13-3/h4-7,11H,8H2,1-3H3 |
| InChIKey | BQTOTVBOOGPLPR-UHFFFAOYSA-N |
| Molecular Weight | 180.247 g/mol |
| SMILES | C(CC1=CC=C(C=C1)C)(OC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.927685 |