| SpectraBase Spectrum ID |
6FROvSsmhxS |
| Name |
2,3-Diethyl-7-(tert-butoxy)indenone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
258.161979946 u |
| Formula |
C17H22O2 |
| InChI |
InChI=1S/C17H22O2/c1-6-11-12(7-2)16(18)15-13(11)9-8-10-14(15)19-17(3,4)5/h8-10H,6-7H2,1-5H3 |
| InChIKey |
ROTMLLVCFTYNTO-UHFFFAOYSA-N |
| Molecular Weight |
258.361 g/mol |
| SMILES |
C1(C2=C(C=CC=C2OC(C)(C)C)C(=C1CC)CC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.963306 |
