| SpectraBase Spectrum ID |
1FC9bH5gvTx |
| Name |
2-(p-Methoxybenzyl)-6-(pentafluoroethyl)-6-hydroxy-2-azabicyclo[2.2.1]heptan-3-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H16F5NO3 |
| InChI |
InChI=1S/C16H16F5NO3/c1-25-11-4-2-9(3-5-11)8-22-12-6-10(13(22)23)7-14(12,24)15(17,18)16(19,20)21/h2-5,10,12,24H,6-8H2,1H3/t10-,12+,14-/m1/s1 |
| InChIKey |
CUOWUAGEAVRPRS-SCDSUCTJSA-N |
| Molecular Weight |
365.300 g/mol |
| SMILES |
O[C@@]1(C(C(F)(F)F)(F)F)[C@]2(N(C(=O)[C@@](C1)(C2)[H])Cc1ccc(cc1)OC)[H] |
| SPLASH |
splash10-00di-0904000000-fadb5021e6f57e22cc96 |
| Source of Spectrum |
AF-49-7409-21b |
| Wiley ID |
1694184 |
![2-(p-Methoxybenzyl)-6-(pentafluoroethyl)-6-hydroxy-2-azabicyclo[2.2.1]heptan-3-one](/api/spectrum/1FC9bH5gvTx/structure.png?h=300&w=458 "2-(p-Methoxybenzyl)-6-(pentafluoroethyl)-6-hydroxy-2-azabicyclo[2.2.1]heptan-3-one")
