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1-(1-Adamantyl)-4-[(4-tert-butylphenyl)sulfonyl]piperazine
SpectraBase Compound ID 8KC6Vctjpaa
InChI InChI=1S/C24H36N2O2S/c1-23(2,3)21-4-6-22(7-5-21)29(27,28)26-10-8-25(9-11-26)24-15-18-12-19(16-24)14-20(13-18)17-24/h4-7,18-20H,8-17H2,1-3H3
InChIKey DXKPGAVUKLTUGB-UHFFFAOYSA-N
Mol Weight 416.6 g/mol
Molecular Formula C24H36N2O2S
Exact Mass 416.24975 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AxLeuQ4Iy3m
Name 1-(1-Adamantyl)-4-[(4-tert-butylphenyl)sulfonyl]piperazine
Alternate Name(s) 1-Adamantan-1-yl-4-(4-tert-butyl-benzenesulfonyl)-piperazine 1-(1-adamantyl)-4-(4-tert-butylphenyl)sulfonylpiperazine
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Formula C24H36N2O2S
InChI InChI=1S/C24H36N2O2S/c1-23(2,3)21-4-6-22(7-5-21)29(27,28)26-10-8-25(9-11-26)24-15-18-12-19(16-24)14-20(13-18)17-24/h4-7,18-20H,8-17H2,1-3H3
InChIKey DXKPGAVUKLTUGB-UHFFFAOYSA-N
Molecular Weight 416.624 g/mol
SMILES C12(CC3CC(C2)CC(C1)C3)N1CCN(CC1)S(c1ccc(cc1)C(C)(C)C)(=O)=O
SPLASH splash10-014r-2790000000-2a159fe7d4793cf1cbb9
Wiley ID 1443356