| SpectraBase Spectrum ID |
32Z4eGfObTl |
| Name |
cis-5,5-Diethoxycarbonyl-3A,4-dihydro-6-(4-fluorophenyl)-3H,6H-cyclopenta[3.4-C]isoxazole |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
349.132550906 u |
| Formula |
C18H20FNO5 |
| InChI |
InChI=1S/C18H20FNO5/c1-3-23-16(21)18(17(22)24-4-2)9-12-10-25-20-15(12)14(18)11-5-7-13(19)8-6-11/h5-8,12,14H,3-4,9-10H2,1-2H3/t12-,14+/m0/s1 |
| InChIKey |
QCDQAGXDIZHLEA-GXTWGEPZSA-N |
| Molecular Weight |
349.358 g/mol |
| SMILES |
C1([C@@](C2=NOC[C@@]2(C1)[H])(C=1C=CC(=CC1)F)[H])(C(=O)OCC)C(=O)OCC |
![cis-5,5-Diethoxycarbonyl-3a,4-dihydro-6-(4-fluorophenyl)-3H,6H-cyclopenta[3.4-c]isoxazole](/api/spectrum/32Z4eGfObTl/structure.png?h=300&w=458 "cis-5,5-Diethoxycarbonyl-3a,4-dihydro-6-(4-fluorophenyl)-3H,6H-cyclopenta[3.4-c]isoxazole")
