| SpectraBase Spectrum ID |
HLnxkcw9U8d |
| Name |
(3aR,4R,7R,7aR)-7-Acetylamino-4-hydroxy-2,2-dimethyl-3a,4,7,7a-tetrahydro-benzo[1,3]dioxole-4-carboxylicacid ethyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H21NO6 |
| InChI |
InChI=1S/C14H21NO6/c1-5-19-12(17)14(18)7-6-9(15-8(2)16)10-11(14)21-13(3,4)20-10/h6-7,9-11,18H,5H2,1-4H3,(H,15,16)/t9-,10-,11-,14-/m1/s1 |
| InChIKey |
HDMNFQUAAIVOJM-ZHSDAYTOSA-N |
| Molecular Weight |
299.323 g/mol |
| SMILES |
N([C@]1([C@@]2([C@]([C@](C=C1)(C(=O)OCC)O)(OC(O2)(C)C)[H])[H])[H])C(=O)C |
| SPLASH |
splash10-001m-9400000000-f9ebc8ffa7565bf8c9f4 |
| Source of Spectrum |
F5-7-2626-34 |
| Synonyms |
Ethyl 2,2-dimethyl-7-(acetylamino)-4-hydroxy-3a,4,7,7a-tetrahydrobenzo[1,3]dioxole-4-carboxylate |
| Wiley ID |
1696622 |
![(3aR,4R,7R,7aR)-7-Acetylamino-4-hydroxy-2,2-dimethyl-3a,4,7,7a-tetrahydro-benzo[1,3]dioxole-4-carboxylicacid ethyl ester](/api/spectrum/HLnxkcw9U8d/structure.png?h=300&w=458 "(3aR,4R,7R,7aR)-7-Acetylamino-4-hydroxy-2,2-dimethyl-3a,4,7,7a-tetrahydro-benzo[1,3]dioxole-4-carboxylicacid ethyl ester")
