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1-(1-Adamantyl)-4-[(3,4-dichlorophenyl)sulfonyl]piperazine
SpectraBase Compound ID LX0EDiQfyJz
InChI InChI=1S/C20H26Cl2N2O2S/c21-18-2-1-17(10-19(18)22)27(25,26)24-5-3-23(4-6-24)20-11-14-7-15(12-20)9-16(8-14)13-20/h1-2,10,14-16H,3-9,11-13H2
InChIKey HUQNMPBMMHHCIB-UHFFFAOYSA-N
Mol Weight 429.41 g/mol
Molecular Formula C20H26Cl2N2O2S
Exact Mass 428.109205 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9ukA5FFLB9E
Name 1-(1-Adamantyl)-4-[(3,4-dichlorophenyl)sulfonyl]piperazine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H26Cl2N2O2S
InChI InChI=1S/C20H26Cl2N2O2S/c21-18-2-1-17(10-19(18)22)27(25,26)24-5-3-23(4-6-24)20-11-14-7-15(12-20)9-16(8-14)13-20/h1-2,10,14-16H,3-9,11-13H2
InChIKey HUQNMPBMMHHCIB-UHFFFAOYSA-N
Molecular Weight 429.406 g/mol
SMILES C12(N3CCN(CC3)S(c3ccc(c(c3)Cl)Cl)(=O)=O)CC3CC(C2)CC(C1)C3
SPLASH splash10-00ku-9730000000-fa925a96a11c7dcf813b
Synonyms 1-Adamantan-1-yl-4-(3,4-dichloro-benzenesulfonyl)-piperazine 1-(1-adamantyl)-4-(3,4-dichlorophenyl)sulfonylpiperazine
Wiley ID 1445591