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8-(3-Noradamantyl)-3-propyl-6-thioxanthine
SpectraBase Compound ID 50MqW77HrU6
InChI InChI=1S/C17H22N4OS/c1-2-3-21-13-12(14(23)20-16(21)22)18-15(19-13)17-7-9-4-10(8-17)6-11(17)5-9/h9-11H,2-8H2,1H3,(H,18,19)(H,20,22,23)/t9-,10+,11?,17?
InChIKey NJYWMDIZPKZHCP-UHFFFAOYSA-N
Mol Weight 330.45 g/mol
Molecular Formula C17H22N4OS
Exact Mass 330.151433 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AVB9jxBZELc
Name 8-(3-Noradamantyl)-3-propyl-6-thioxanthine
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22N4OS
InChI InChI=1S/C17H22N4OS/c1-2-3-21-13-12(14(23)20-16(21)22)18-15(19-13)17-7-9-4-10(8-17)6-11(17)5-9/h9-11H,2-8H2,1H3,(H,18,19)(H,20,22,23)/t9-,10+,11?,17?
InChIKey NJYWMDIZPKZHCP-UHFFFAOYSA-N
Molecular Weight 330.450 g/mol
SMILES [nH]1c(nc2N(C(NC(c12)=S)=O)CCC)C12C3C[C@@](C2)(C[C@@](C1)(C3)[H])[H]
SPLASH splash10-001i-0029000000-9344f5edd24f228a6af7
Source of Spectrum E1-36-2516-3
Synonyms 3-Propyl-6-thioxo-8-tricyclo[3.3.1.0(3,7)]non-3-yl-1,3,6,7-tetrahydro-2H-purin-2-one
Wiley ID 1574703