SpectraBase Spectrum ID |
4IzBTvH0Rq0 |
Name |
N-[3-chloro-5-(trifluoromethyl)phenyl]adamantane-1-carboxamide |
Appearance |
White solid |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H19ClF3NO |
InChI |
InChI=1S/C18H19ClF3NO/c19-14-4-13(18(20,21)22)5-15(6-14)23-16(24)17-7-10-1-11(8-17)3-12(2-10)9-17/h4-6,10-12H,1-3,7-9H2,(H,23,24)/t10-,11+,12-,17- |
InChIKey |
OZYPLLXXOHFUMH-UHFFFAOYSA-N |
Instrument Name |
GCMS |
Ionization Type |
EI |
Literature Reference DOI |
10.1021/acs.jmedchem.7b00908 |
Molecular Weight |
357.804 g/mol |
Reported Formula |
C18H19ClF3NO |
SMILES |
N(c1cc(Cl)cc(c1)C(F)(F)F)C(=O)C12C[C@]3(C[C@](C[C@@](C2)(C3)[H])(C1)[H])[H] |
SPLASH |
splash10-000i-2900000000-e94dcf7ddb4d7483ab32 |
Source of Spectrum |
AF-61-SM14-18u |
Wiley ID |
1879443 |