| SpectraBase Spectrum ID |
AuZPkLe39Zg |
| Name |
6-Ethyl-3,4-dihydro-2,2-dimethyl-2H-1-benzopyran |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
190.135765199 u |
| Formula |
C13H18O |
| InChI |
InChI=1S/C13H18O/c1-4-10-5-6-12-11(9-10)7-8-13(2,3)14-12/h5-6,9H,4,7-8H2,1-3H3 |
| InChIKey |
BUIXGRYMAWVUCL-UHFFFAOYSA-N |
| Molecular Weight |
190.286 g/mol |
| SMILES |
C=12OC(CCC2=CC(=CC1)CC)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.951351 |
