| SpectraBase Spectrum ID |
F0sYPVKUJmV |
| Name |
Benzoic acid (3R,3aR,6R,7R,7aS)-7-bromo-6-hydroxy-6-methyl-5-oxo-octahydro-benzofuran-3-ylmethyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H19BrO5 |
| InChI |
InChI=1S/C17H19BrO5/c1-17(21)13(19)7-12-11(8-22-14(12)15(17)18)9-23-16(20)10-5-3-2-4-6-10/h2-6,11-12,14-15,21H,7-9H2,1H3/t11-,12-,14+,15-,17-/m1/s1 |
| InChIKey |
VAMHNSKZXALWOE-LGKWMFPGSA-N |
| Molecular Weight |
383.238 g/mol |
| SMILES |
O[C@]1([C@@]([C@]2(OC[C@@]([C@]2(CC1=O)[H])(COC(=O)c1ccccc1)[H])[H])(Br)[H])C |
| SPLASH |
splash10-0a4i-1900000000-7716c561558668b77189 |
| Source of Spectrum |
D1-2006-1054-22 |
| Synonyms |
7-Bromo-3-[(benzoyloxy)methyl]-6-methyl-6-hydroxy-5-oxo-(perhydro)-benzofuran
[(3R,3aR,6R,7R,7aS)-7-bromo-6-hydroxy-6-methyl-5-oxooctahydro-1-benzofuran-3-yl]methyl benzoate |
| Wiley ID |
1614008 |
