| SpectraBase Spectrum ID |
D6JhZlXlsP0 |
| Name |
2-Propenal, 3-[4-(1,1-dimethylethoxy)phenyl]-2-methyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
218.130679818 u |
| Formula |
C14H18O2 |
| InChI |
InChI=1S/C14H18O2/c1-11(10-15)9-12-5-7-13(8-6-12)16-14(2,3)4/h5-10H,1-4H3/b11-9+ |
| InChIKey |
ZKVFLACHVWRRMF-PKNBQFBNSA-N |
| Molecular Weight |
218.296 g/mol |
| SMILES |
C1(=CC=C(C=C1)OC(C)(C)C)\C=C\(C=O)C |
| Spectrum/Structure Validation Score (Raman) |
0.810042 |
![2-Propenal, 3-[4-(1,1-dimethylethoxy)phenyl]-2-methyl-](/api/spectrum/D6JhZlXlsP0/structure.png?h=300&w=458 "2-Propenal, 3-[4-(1,1-dimethylethoxy)phenyl]-2-methyl-")
