| SpectraBase Spectrum ID |
1FY5LcBSYLx |
| Name |
N-[2-(2-Thienyl)benzoxazol-6-yl]adamantane-1-carboxamide |
| Appearance |
Orange crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H22N2O2S |
| InChI |
InChI=1S/C22H22N2O2S/c25-21(22-10-13-6-14(11-22)8-15(7-13)12-22)23-16-3-4-17-18(9-16)26-20(24-17)19-2-1-5-27-19/h1-5,9,13-15H,6-8,10-12H2,(H,23,25)/t13-,14+,15-,22- |
| InChIKey |
AHUCFSGXOVEGDT-CNNQHEGBSA-N |
| Instrument Name |
Finnigan MAT95 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhet.3062 |
| Molecular Weight |
378.490 g/mol |
| Reported Formula |
C22H22N2O2S |
| SMILES |
N(C(C12C[C@]3(C[C@@](C2)(C[C@](C3)(C1)[H])[H])[H])=O)c1cc2c(cc1)nc(o2)-c1cccs1 |
| SPLASH |
splash10-002r-2906000000-f2f3df69952210033af5 |
| Source of Spectrum |
Y-55-452-7e |
| Thin-Layer Chromatography |
Rf = 0.70 (SiO2, hexanes/EtOAc, 2:1) |
| Wiley ID |
1879011 |
![N-[2-(2-Thienyl)benzoxazol-6-yl]adamantane-1-carboxamide](/api/spectrum/1FY5LcBSYLx/structure.png?h=300&w=458 "N-[2-(2-Thienyl)benzoxazol-6-yl]adamantane-1-carboxamide")
