SpectraBase Spectrum ID |
L1L8BMufezi |
Name |
3-[2-Benzoyl-3-benzylmercaptopropyl]-4-hydroxy-6-methylpyran-2-one |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C23H22O4S |
InChI |
InChI=1S/C23H22O4S/c1-16-12-21(24)20(23(26)27-16)13-19(22(25)18-10-6-3-7-11-18)15-28-14-17-8-4-2-5-9-17/h2-12,19,24H,13-15H2,1H3 |
InChIKey |
RDQBTZDEPDYMKU-UHFFFAOYSA-N |
Molecular Weight |
394.485 g/mol |
SMILES |
OC1=C(C(OC(=C1)C)=O)CC(C(=O)c1ccccc1)CSCc1ccccc1 |
SPLASH |
splash10-0006-9000000000-c0a382dd6d3e1e93d138 |
Source of Spectrum |
H1-53-2434-14 |
Wiley ID |
818085 |