| SpectraBase Spectrum ID |
15HERxwLPU |
| Name |
Ethyl (9R,9aS)-9-(Nitromethyl)-2,3,9,9a-tetrahydro-1H-xanthren-9a-carboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H19NO5 |
| InChI |
InChI=1S/C17H19NO5/c1-2-22-16(19)17-10-6-5-9-15(17)23-14-8-4-3-7-12(14)13(17)11-18(20)21/h3-4,7-9,13H,2,5-6,10-11H2,1H3/t13-,17+/m1/s1 |
| InChIKey |
GMEKQCQKVHTXTG-DYVFJYSZSA-N |
| Molecular Weight |
317.341 g/mol |
| SMILES |
[C@]12(C(Oc3c([C@]2(CN(=O)=O)[H])cccc3)=CCCC1)C(=O)OCC |
| SPLASH |
splash10-03yk-0953000000-2eb44b570e537f00dba2 |
| Source of Spectrum |
F4-44-779-5h |
| Wiley ID |
1706922 |
