| SpectraBase Spectrum ID |
Ln02qmuCoBT |
| Name |
rel-(3aR,9aS)-3-Benzoyl-3a,4,5,6,7,8,9,9a-octahydrocycloocta[1,2-d]isoxazole 2-oxide |
| Alternate Name(s) |
[(3aR,9aS)-2-oxido-3a,4,5,6,7,8,9,9a-octahydrocycloocta[d]isoxazol-3-yl](phenyl)methanone |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H19NO3 |
| InChI |
InChI=1S/C16H19NO3/c18-16(12-8-4-3-5-9-12)15-13-10-6-1-2-7-11-14(13)20-17(15)19/h3-5,8-9,13-14H,1-2,6-7,10-11H2/t13-,14-/m0/s1 |
| InChIKey |
ACLFTQSOTIQJAD-KBPBESRZSA-N |
| Molecular Weight |
273.332 g/mol |
| SMILES |
C1(=[N+](O[C@]2(CCCCCC[C@]12[H])[H])[O-])C(=O)c1ccccc1 |
| SPLASH |
splash10-0ab9-0900000000-8d2439fb1106f9949ff7 |
| Source of Spectrum |
KC-0-2034-3 |
| Wiley ID |
781608 |
![rel-(3aR,9aS)-3-Benzoyl-3a,4,5,6,7,8,9,9a-octahydrocycloocta[1,2-d]isoxazole 2-oxide](/api/spectrum/Ln02qmuCoBT/structure.png?h=300&w=458 "rel-(3aR,9aS)-3-Benzoyl-3a,4,5,6,7,8,9,9a-octahydrocycloocta[1,2-d]isoxazole 2-oxide")
