| SpectraBase Compound ID | KhjnL29AlN2 |
|---|---|
| InChI | InChI=1S/C14H22O2/c1-13(2,3)15-11-8-7-9-12(10-11)16-14(4,5)6/h7-10H,1-6H3 |
| InChIKey | HIQUVLYPUNAUEL-UHFFFAOYSA-N |
| Mol Weight | 222.33 g/mol |
| Molecular Formula | C14H22O2 |
| Exact Mass | 222.16198 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | xBQu8CABpD |
|---|---|
| Name | Benzene, 1,3-bis(1,1-dimethylethoxy)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 222.161979946 u |
| Formula | C14H22O2 |
| InChI | InChI=1S/C14H22O2/c1-13(2,3)15-11-8-7-9-12(10-11)16-14(4,5)6/h7-10H,1-6H3 |
| InChIKey | HIQUVLYPUNAUEL-UHFFFAOYSA-N |
| Molecular Weight | 222.328 g/mol |
| SMILES | C1(=CC(=CC=C1)OC(C)(C)C)OC(C)(C)C |
| Spectrum/Structure Validation Score (Raman) | 0.949396 |