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4-(1-Adamantyl)aniline
SpectraBase Compound ID 3ycNGlfVwQ1
InChI InChI=1S/C16H21N/c17-15-3-1-14(2-4-15)16-8-11-5-12(9-16)7-13(6-11)10-16/h1-4,11-13H,5-10,17H2/t11-,12+,13-,16-
InChIKey JMBDVVUBXKXCIU-WTHWONHRSA-N
Mol Weight 227.35 g/mol
Molecular Formula C16H21N
Exact Mass 227.1674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4trVenTCLWp
Name 4-(1-Adamantyl)aniline
Appearance Brown solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21N
InChI InChI=1S/C16H21N/c17-15-3-1-14(2-4-15)16-8-11-5-12(9-16)7-13(6-11)10-16/h1-4,11-13H,5-10,17H2/t11-,12+,13-,16-
InChIKey JMBDVVUBXKXCIU-WTHWONHRSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1021/acs.joc.0c02917
Molecular Weight 227.351 g/mol
SMILES Nc1ccc(C23C[C@]4(C[C@@](C3)(C[C@@](C2)(C4)[H])[H])[H])cc1
SPLASH splash10-00fr-1940000000-12b5b6e31eefa5651b12
Source of Spectrum JOC-86-4492-8
Wiley ID 1867941