| SpectraBase Spectrum ID |
DEaMPmrCeTG |
| Name |
(3aR,7R,7aS)-7-hydroxy-2,2-dimethyl-3a,6,7,7a-tetrahydro-1,3-benzodioxole-5-carboxylic acid methyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H16O5 |
| InChI |
InChI=1S/C11H16O5/c1-11(2)15-8-5-6(10(13)14-3)4-7(12)9(8)16-11/h5,7-9,12H,4H2,1-3H3/t7-,8-,9+/m1/s1 |
| InChIKey |
BPQMQIJLKGETOF-HLTSFMKQSA-N |
| Molecular Weight |
228.244 g/mol |
| SMILES |
O[C@]1([C@]2([C@@](C=C(C(=O)OC)C1)(OC(C)(C)O2)[H])[H])[H] |
| SPLASH |
splash10-0a4l-9300000000-5e5743d980491f88f6ba |
| Source of Spectrum |
J-57-5800-2 |
| Synonyms |
Methyl (3aR,7R,7aS)-2,2-dimethyl-7-oxidanyl-3a,6,7,7a-tetrahydro-1,3-benzodioxole-5-carboxylate
Methyl (3aR,7R,7aS)-7-hydroxy-2,2-dimethyl-3a,6,7,7a-tetrahydro-1,3-benzodioxole-5-carboxylate |
| Wiley ID |
1229396 |
