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1-[(5-tert-butyl-2,3-dimethylbenzene)sulfonyl]-4-(2-methoxyphenyl)piperazine
SpectraBase Compound ID 9v2qXQOPSnp
InChI InChI=1S/C23H32N2O3S/c1-17-15-19(23(3,4)5)16-22(18(17)2)29(26,27)25-13-11-24(12-14-25)20-9-7-8-10-21(20)28-6/h7-10,15-16H,11-14H2,1-6H3
InChIKey XYNKIAVYYAXRIA-UHFFFAOYSA-N
Mol Weight 416.6 g/mol
Molecular Formula C23H32N2O3S
Exact Mass 416.213364 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7jfFzmnpteS
Name 1-[(5-tert-butyl-2,3-dimethylbenzene)sulfonyl]-4-(2-methoxyphenyl)piperazine
Alternate Name(s) Piperazine, 1-[[5-(1,1-dimethylethyl)-2,3-dimethylphenyl]sulfonyl]-4-(2-methoxyphenyl)- 1-(5-tert-butyl-2,3-dimethylphenyl)sulfonyl-4-(2-methoxyphenyl)piperazine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H32N2O3S
InChI InChI=1S/C23H32N2O3S/c1-17-15-19(23(3,4)5)16-22(18(17)2)29(26,27)25-13-11-24(12-14-25)20-9-7-8-10-21(20)28-6/h7-10,15-16H,11-14H2,1-6H3
InChIKey XYNKIAVYYAXRIA-UHFFFAOYSA-N
Molecular Weight 416.580 g/mol
SMILES c1ccc(N2CCN(S(c3cc(C(C)(C)C)cc(c3C)C)(=O)=O)CC2)c(OC)c1
SPLASH splash10-0006-1900000000-0f8a6414fbf92fe5e995
Source of Spectrum IY-2-4989-7
Wiley ID 1657880