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1-(1-Adamantyl)-4-[(2-methoxy-4,5-dimethylphenyl)sulfonyl]piperazine
SpectraBase Compound ID 5gwyOqF2lPn
InChI InChI=1S/C23H34N2O3S/c1-16-8-21(28-3)22(9-17(16)2)29(26,27)25-6-4-24(5-7-25)23-13-18-10-19(14-23)12-20(11-18)15-23/h8-9,18-20H,4-7,10-15H2,1-3H3
InChIKey QZNZOBOKUWWCKM-UHFFFAOYSA-N
Mol Weight 418.6 g/mol
Molecular Formula C23H34N2O3S
Exact Mass 418.229014 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AzW0FpPxDTT
Name 1-(1-Adamantyl)-4-[(2-methoxy-4,5-dimethylphenyl)sulfonyl]piperazine
Alternate Name(s) 1-Adamantan-1-yl-4-(2-methoxy-4,5-dimethyl-benzenesulfonyl)-piperazine 2-{[4-(1-adamantyl)-1-piperazinyl]sulfonyl}-4,5-dimethylphenyl methyl ether 1-(1-adamantyl)-4-(2-methoxy-4,5-dimethylphenyl)sulfonylpiperazine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H34N2O3S
InChI InChI=1S/C23H34N2O3S/c1-16-8-21(28-3)22(9-17(16)2)29(26,27)25-6-4-24(5-7-25)23-13-18-10-19(14-23)12-20(11-18)15-23/h8-9,18-20H,4-7,10-15H2,1-3H3
InChIKey QZNZOBOKUWWCKM-UHFFFAOYSA-N
Molecular Weight 418.596 g/mol
SMILES C12(CC3CC(C2)CC(C1)C3)N1CCN(CC1)S(c1cc(c(cc1OC)C)C)(=O)=O
SPLASH splash10-014r-3890100000-bd9fbdc80222b5fab1c5
Wiley ID 1443353