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3,5,7-TRI-N-PROPYL-1-AZAADAMANTAN-4,6-DIONE
SpectraBase Compound ID leaNG3mV2r
InChI InChI=1S/C18H29NO2/c1-4-7-16-10-17(8-5-2)12-19(11-16)13-18(9-6-3,14(16)20)15(17)21/h4-13H2,1-3H3/t16-,17+,18+
InChIKey UYZWSQLQXSQTAG-PIIMJCKOSA-N
Mol Weight 291.44 g/mol
Molecular Formula C18H29NO2
Exact Mass 291.219829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1jc2oY2NE5O
Name 3,5,7-tri-n-propyl-1-azaadamantane-4,6-dione
Alternate Name(s) 3,5,7-tripropyl-1-azatricyclo[3.3.1.1(3,7)]decane-4,6-dione
CAS Registry Number 137628-72-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H29NO2
InChI InChI=1S/C18H29NO2/c1-4-7-16-10-17(8-5-2)12-19(11-16)13-18(9-6-3,14(16)20)15(17)21/h4-13H2,1-3H3/t16-,17+,18+
InChIKey UYZWSQLQXSQTAG-PIIMJCKOSA-N
Molecular Weight 291.435 g/mol
SMILES [C@]12(C([C@@]3(CCC)CN(C2)C[C@@](C1=O)(C3)CCC)=O)CCC
SPLASH splash10-01qc-2590000000-75bcdb8df033209d1073
Source of Spectrum K-125-462-2
Wiley ID 1294731