| SpectraBase Spectrum ID |
7TNTpGsnzps |
| Name |
2-(4-Methylphenyl)octan-3-one |
| Alternate Name(s) |
2-(4-methylphenyl)-3-octanone |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H22O |
| InChI |
InChI=1S/C15H22O/c1-4-5-6-7-15(16)13(3)14-10-8-12(2)9-11-14/h8-11,13H,4-7H2,1-3H3 |
| InChIKey |
ACSPQIJIAUVEGO-UHFFFAOYSA-N |
| Molecular Weight |
218.340 g/mol |
| SMILES |
CC(C(CCCCC)=O)c1ccc(cc1)C |
| SPLASH |
splash10-014i-0910000000-55d4cca9d559b873ea32 |
| Source of Spectrum |
F4-0-3450-4 |
| Wiley ID |
1620852 |
