| SpectraBase Spectrum ID |
Kg0AgW8h0Z3 |
| Name |
9-Methyl-1-phenyldecan-1-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
246.198365456 u |
| Formula |
C17H26O |
| InChI |
InChI=1S/C17H26O/c1-15(2)11-7-4-3-5-10-14-17(18)16-12-8-6-9-13-16/h6,8-9,12-13,15H,3-5,7,10-11,14H2,1-2H3 |
| InChIKey |
NWMOWTHLIXLVOY-UHFFFAOYSA-N |
| Molecular Weight |
246.394 g/mol |
| SMILES |
C(CCCCCCCC(C)C)(=O)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.95812 |
