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1-(1-adamantyl)-4-p-phenetylsulfonyl-piperazine
SpectraBase Compound ID 5Yy5p9Fko6s
InChI InChI=1S/C22H32N2O3S/c1-2-27-20-3-5-21(6-4-20)28(25,26)24-9-7-23(8-10-24)22-14-17-11-18(15-22)13-19(12-17)16-22/h3-6,17-19H,2,7-16H2,1H3
InChIKey IJPUVGVUXWSXCJ-UHFFFAOYSA-N
Mol Weight 404.6 g/mol
Molecular Formula C22H32N2O3S
Exact Mass 404.213364 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3WbMmLNsPJM
Name 1-(1-adamantyl)-4-p-phenetylsulfonyl-piperazine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H32N2O3S
InChI InChI=1S/C22H32N2O3S/c1-2-27-20-3-5-21(6-4-20)28(25,26)24-9-7-23(8-10-24)22-14-17-11-18(15-22)13-19(12-17)16-22/h3-6,17-19H,2,7-16H2,1H3
InChIKey IJPUVGVUXWSXCJ-UHFFFAOYSA-N
Molecular Weight 404.569 g/mol
SMILES CCOc1ccc(S(N2CCN(C34CC5CC(C4)CC(C3)C5)CC2)(=O)=O)cc1
SPLASH splash10-00kr-3930000000-4117106db3386835a098
Synonyms 1-(1-adamantyl)-4-(4-ethoxyphenyl)sulfonylpiperazine
Wiley ID 1465121