| SpectraBase Spectrum ID |
CaoKx1kXCtN |
| Name |
6'-Hydroxy-3'-isopropyl-2'-methylheptanophenone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
262.193280075 u |
| Formula |
C17H26O2 |
| InChI |
InChI=1S/C17H26O2/c1-5-6-7-8-9-15(18)17-13(4)14(12(2)3)10-11-16(17)19/h10-12,19H,5-9H2,1-4H3 |
| InChIKey |
FQLCUBTZRKOWEO-UHFFFAOYSA-N |
| Molecular Weight |
262.393 g/mol |
| SMILES |
OC=1C(=C(C(=CC1)C(C)C)C)C(CCCCCC)=O |
| Spectrum/Structure Validation Score (Raman) |
0.990914 |
