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1-Benzyl-3,5,7-trimethyl-1-azoniaadamantanebromide
SpectraBase Compound ID 69dqQkyJXlZ
InChI InChI=1S/C19H28N.BrH/c1-17-10-18(2)12-19(3,11-17)15-20(13-17,14-18)9-16-7-5-4-6-8-16;/h4-8H,9-15H2,1-3H3;1H/q+1;/p-1/t17-,18+,19-,20+;
InChIKey OQTDQNWLSPXETE-IGDLELKWSA-M
Mol Weight 350.34 g/mol
Molecular Formula C19H28BrN
Exact Mass 349.140513 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1i0BlmAr2W
Name 1-Benzyl-3,5,7-trimethyl-1-azoniaadamantanebromide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H28BrN
InChI InChI=1S/C19H28N.BrH/c1-17-10-18(2)12-19(3,11-17)15-20(13-17,14-18)9-16-7-5-4-6-8-16;/h4-8H,9-15H2,1-3H3;1H/q+1;/p-1/t17-,18+,19-,20+;
InChIKey OQTDQNWLSPXETE-IGDLELKWSA-M
Literature Reference DOI 10.1002/cber.19921250225
Molecular Weight 350.344 g/mol
SMILES [Br-].[C@]12(C[C@@]3(C[C@](C2)(C[N@+](C1)(C3)Cc1ccccc1)C)C)C
SPLASH splash10-052f-9100000000-9e38a3cd43ae7d1725d3
Source of Spectrum K-125-464-6a
Synonyms (3s,5s,7s)-1-benzyl-3,5,7-trimethyl-1-azaadamantan-1-ium bromide
Wiley ID 1790460