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1-(1-adamantyl)-4-(4-propan-2-ylphenyl)sulfonyl-piperazine
SpectraBase Compound ID 1wxJCX8qMDJ
InChI InChI=1S/C23H34N2O2S/c1-17(2)21-3-5-22(6-4-21)28(26,27)25-9-7-24(8-10-25)23-14-18-11-19(15-23)13-20(12-18)16-23/h3-6,17-20H,7-16H2,1-2H3
InChIKey TXUPPQDKPCVYJB-UHFFFAOYSA-N
Mol Weight 402.6 g/mol
Molecular Formula C23H34N2O2S
Exact Mass 402.2341 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KdwKHoS3YB4
Name 1-(1-adamantyl)-4-(4-propan-2-ylphenyl)sulfonyl-piperazine
Alternate Name(s) 1-(1-adamantyl)-4-p-cumenylsulfonyl-piperazine 1-(1-adamantyl)-4-(4-propan-2-ylphenyl)sulfonylpiperazine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H34N2O2S
InChI InChI=1S/C23H34N2O2S/c1-17(2)21-3-5-22(6-4-21)28(26,27)25-9-7-24(8-10-25)23-14-18-11-19(15-23)13-20(12-18)16-23/h3-6,17-20H,7-16H2,1-2H3
InChIKey TXUPPQDKPCVYJB-UHFFFAOYSA-N
Molecular Weight 402.597 g/mol
SMILES C12(CC3CC(C2)CC(C1)C3)N1CCN(CC1)S(c1ccc(cc1)C(C)C)(=O)=O
SPLASH splash10-014i-2690100000-c6892a4ffc135036a471
Wiley ID 1443354