For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
N-[(Adamant-1-yl)methyl]-3-fluoro-5-(trifluoromethyl)-aniline Hydrochloride
SpectraBase Compound ID 3ZNvA1DqTRa
InChI InChI=1S/C18H21F4N.Cl/c19-15-4-14(18(20,21)22)5-16(6-15)23-10-17-7-11-1-12(8-17)3-13(2-11)9-17;/h4-6,11-13,23H,1-3,7-10H2;/t11-,12+,13-,17-;
InChIKey UYXGBBMVNISINI-RPOWCGIFSA-N
Mol Weight 362.82 g/mol
Molecular Formula C18H21ClF4N
Exact Mass 362.129865 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 6DjPOaGBD2N
Name N-[(Adamant-1-yl)methyl]-3-fluoro-5-(trifluoromethyl)-aniline Hydrochloride
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22ClF4N
InChI InChI=1S/C18H21F4N.Cl/c19-15-4-14(18(20,21)22)5-16(6-15)23-10-17-7-11-1-12(8-17)3-13(2-11)9-17;/h4-6,11-13,23H,1-3,7-10H2;/t11-,12+,13-,17-;
InChIKey UYXGBBMVNISINI-RPOWCGIFSA-N
Ionization Type EI
Literature Reference DOI 10.1021/acs.jmedchem.7b00908
Molecular Weight 363.828 g/mol
SMILES N(CC12C[C@]3(C[C@](C[C@@](C2)(C3)[H])(C1)[H])[H])c1cc(cc(c1)C(F)(F)F)F.Cl
SPLASH splash10-002r-2905000000-f30a700071006157d008
Source of Spectrum AF-61-114-19t
Wiley ID 1879431