| SpectraBase Spectrum ID |
1ePhdaceIUC |
| Name |
4-(1-Adamantyl)-5-(2-thienyl)-3-trifluoromethyl-1H-pyrazole |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H19F3N2S |
| InChI |
InChI=1S/C18H19F3N2S/c19-18(20,21)16-14(15(22-23-16)13-2-1-3-24-13)17-7-10-4-11(8-17)6-12(5-10)9-17/h1-3,10-12H,4-9H2,(H,22,23)/t10-,11+,12-,17- |
| InChIKey |
QTSODRWGWQXTAD-KVMGNAQRSA-N |
| Molecular Weight |
352.419 g/mol |
| SMILES |
[nH]1nc(c(c1-c1sccc1)C12C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H])C(F)(F)F |
| SPLASH |
splash10-0udi-2109000000-ca2653b31af569e7d8ba |
| Source of Spectrum |
O1-46-1179-2f |
| Wiley ID |
1669387 |
