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N-[(Adamant-1-yl)methyl]-2-methylaniline Hydrochloride
SpectraBase Compound ID B3Q8Wry9ekq
InChI InChI=1S/C18H25N.ClH/c1-13-4-2-3-5-17(13)19-12-18-9-14-6-15(10-18)8-16(7-14)11-18;/h2-5,14-16,19H,6-12H2,1H3;1H/t14-,15+,16-,18-;
InChIKey YRYZPVLGLCBENU-MEKDLBPXSA-N
Mol Weight 291.87 g/mol
Molecular Formula C18H26ClN
Exact Mass 291.175378 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gi4cDfiHbNW
Name N-[(Adamant-1-yl)methyl]-2-methylaniline Hydrochloride
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H26ClN
InChI InChI=1S/C18H25N.ClH/c1-13-4-2-3-5-17(13)19-12-18-9-14-6-15(10-18)8-16(7-14)11-18;/h2-5,14-16,19H,6-12H2,1H3;1H/t14-,15+,16-,18-;
InChIKey YRYZPVLGLCBENU-MEKDLBPXSA-N
Ionization Type EI
Literature Reference DOI 10.1021/acs.jmedchem.7b00908
Molecular Weight 291.866 g/mol
SMILES N(CC12C[C@]3(C[C@](C[C@@](C2)(C3)[H])(C1)[H])[H])c1c(cccc1)C.Cl
SPLASH splash10-05fr-1950000000-d729ae52d66052adcc05
Source of Spectrum AF-61-112-19c
Wiley ID 1879425