| SpectraBase Spectrum ID |
9kSg6768oIG |
| Name |
Benzenepropanal, 4-methoxy-alpha,alpha-dimethyl-; hydrocinnamaldehyde, p-methoxy-alpha,alpha-dimethyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
192.115029753 u |
| Formula |
C12H16O2 |
| InChI |
InChI=1S/C12H16O2/c1-12(2,9-13)8-10-4-6-11(14-3)7-5-10/h4-7,9H,8H2,1-3H3 |
| InChIKey |
ZIPGUANHDPOQTD-UHFFFAOYSA-N |
| Molecular Weight |
192.258 g/mol |
| SMILES |
C1(=CC=C(C=C1)OC)CC(C=O)(C)C |
| Spectrum/Structure Validation Score (Raman) |
0.916207 |