| SpectraBase Spectrum ID |
7AV83Lf91J0 |
| Name |
Ethyl (3R,4S,5R)-3,4-O-isopropylidene shikimate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H18O5 |
| InChI |
InChI=1S/C12H18O5/c1-4-15-11(14)7-5-8(13)10-9(6-7)16-12(2,3)17-10/h6,8-10,13H,4-5H2,1-3H3/t8-,9-,10+/m1/s1 |
| InChIKey |
YDMLLAZCHMXIOO-BBBLOLIVSA-N |
| Molecular Weight |
242.271 g/mol |
| SMILES |
O[C@]1([C@]2([C@@](C=C(C(=O)OCC)C1)(OC(C)(C)O2)[H])[H])[H] |
| SPLASH |
splash10-004r-3980000000-7f7cd77dc6103ea755ef |
| Source of Spectrum |
QC-20-126-2 |
| Synonyms |
(3aR,7R,7aS)-7-hydroxy-2,2-dimethyl-3a,6,7,7a-tetrahydro-1,3-benzodioxole-5-carboxylic acid ethyl ester
Ethyl (3aR,7R,7aS)-2,2-dimethyl-7-oxidanyl-3a,6,7,7a-tetrahydro-1,3-benzodioxole-5-carboxylate
Ethyl (3aR,7R,7aS)-7-hydroxy-2,2-dimethyl-3a,6,7,7a-tetrahydro-1,3-benzodioxole-5-carboxylate |
| Wiley ID |
1688023 |
