| SpectraBase Spectrum ID |
1aHIw2YUqZp |
| Name |
3-Methyl-3-(4'-isobutyryl)phenylpentandione |
| Alternate Name(s) |
3-(4-isobutyrylphenyl)-3-methyl-2,4-pentanedione |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H20O3 |
| InChI |
InChI=1S/C16H20O3/c1-10(2)15(19)13-6-8-14(9-7-13)16(5,11(3)17)12(4)18/h6-10H,1-5H3 |
| InChIKey |
ZQSBCDIOKDXRAC-UHFFFAOYSA-N |
| Molecular Weight |
260.333 g/mol |
| SMILES |
C(C(=O)C)(C(=O)C)(c1ccc(C(=O)C(C)C)cc1)C |
| SPLASH |
splash10-004i-0920000000-75646082dbd39f83edf2 |
| Source of Spectrum |
F-50-8125-15 |
| Wiley ID |
1264082 |
