| SpectraBase Spectrum ID |
KwZedvpRubU |
| Name |
1-[3-hydroxy-3-(trifluoromethyl)-3a,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-2-yl]-2-(4-nitrophenyl)ethanone |
| Alternate Name(s) |
2-(4-nitrophenyl)-1-[3-oxidanyl-3-(trifluoromethyl)-3a,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-2-yl]ethanone |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H18F3N3O4 |
| InChI |
InChI=1S/C17H18F3N3O4/c18-17(19,20)16(25)13-4-2-1-3-5-14(13)21-22(16)15(24)10-11-6-8-12(9-7-11)23(26)27/h6-9,13,25H,1-5,10H2 |
| InChIKey |
QYZFHWDKCCIZQU-UHFFFAOYSA-N |
| Molecular Weight |
385.343 g/mol |
| SMILES |
OC1(N(N=C2CCCCCC12)C(Cc1ccc(N(=O)=O)cc1)=O)C(F)(F)F |
| SPLASH |
splash10-0udi-9610000000-0f229c51ef502cdf439e |
| Wiley ID |
1511473 |
![1-[3-hydroxy-3-(trifluoromethyl)-3a,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-2-yl]-2-(4-nitrophenyl)ethanone](/api/spectrum/KwZedvpRubU/structure.png?h=300&w=458 "1-[3-hydroxy-3-(trifluoromethyl)-3a,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-2-yl]-2-(4-nitrophenyl)ethanone")
