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N-[(Adamant-1-yl)methyl]aniline Hydrochloride
SpectraBase Compound ID ET8CmxJhXMC
InChI InChI=1S/C17H23N.ClH/c1-2-4-16(5-3-1)18-12-17-9-13-6-14(10-17)8-15(7-13)11-17;/h1-5,13-15,18H,6-12H2;1H/t13-,14+,15-,17-;
InChIKey PXNGIMQZKTZYFG-OSBCYGQKSA-N
Mol Weight 277.84 g/mol
Molecular Formula C17H24ClN
Exact Mass 277.159727 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID uykK9rCC0
Name N-[(Adamant-1-yl)methyl]aniline Hydrochloride
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H24ClN
InChI InChI=1S/C17H23N.ClH/c1-2-4-16(5-3-1)18-12-17-9-13-6-14(10-17)8-15(7-13)11-17;/h1-5,13-15,18H,6-12H2;1H/t13-,14+,15-,17-;
InChIKey PXNGIMQZKTZYFG-OSBCYGQKSA-N
Ionization Type EI
Literature Reference DOI 10.1021/acs.jmedchem.7b00908
Molecular Weight 277.839 g/mol
SMILES N(CC12C[C@]3(C[C@](C[C@@](C2)(C3)[H])(C1)[H])[H])c1ccccc1.Cl
SPLASH splash10-0a4l-2980000000-275fe63be04a9a10236d
Source of Spectrum AF-61-111-19a
Wiley ID 1879423