| SpectraBase Spectrum ID |
BvfMdUeDAJr |
| Name |
Methyl 9-isopropyl-1,6-dimethyl-5-[(phenylsulfonyl)acetyl]heptalene-4-carboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H28O5S |
| InChI |
InChI=1S/C27H28O5S/c1-17(2)20-13-11-19(4)25-23(15-20)18(3)12-14-22(27(29)32-5)26(25)24(28)16-33(30,31)21-9-7-6-8-10-21/h6-15,17H,16H2,1-5H3 |
| InChIKey |
PDQNCTIXGRZORM-UHFFFAOYSA-N |
| Molecular Weight |
464.576 g/mol |
| SMILES |
C=1(C=CC(=C(C2=C(C=CC(=CC12)C(C)C)C)C(=O)CS(=O)(=O)c1ccccc1)C(=O)OC)C |
| SPLASH |
splash10-00di-1249100000-4d410e1381d87bcfc2f1 |
| Source of Spectrum |
H-86-4037-16 |
| Synonyms |
Methyl 7-isopropyl-5,10-dimethyl-1-[(phenylsulfonyl)acetyl]-2-heptalenecarboxylate |
| Wiley ID |
1525728 |
![Methyl 9-isopropyl-1,6-dimethyl-5-[(phenylsulfonyl)acetyl]heptalene-4-carboxylate](/api/spectrum/BvfMdUeDAJr/structure.png?h=300&w=458 "Methyl 9-isopropyl-1,6-dimethyl-5-[(phenylsulfonyl)acetyl]heptalene-4-carboxylate")
