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1-(2,4-dimethylphenyl)-4-(2-methyl-5-nitro-phenyl)sulfonyl-piperazine

View entire compound with spectra: 1 MS (GC)

1-(2,4-dimethylphenyl)-4-(2-methyl-5-nitro-phenyl)sulfonyl-piperazine
SpectraBase Compound ID 8mku8eKpx7b
InChI InChI=1S/C19H23N3O4S/c1-14-4-7-18(16(3)12-14)20-8-10-21(11-9-20)27(25,26)19-13-17(22(23)24)6-5-15(19)2/h4-7,12-13H,8-11H2,1-3H3
InChIKey IJAZNNBMXGGMBP-UHFFFAOYSA-N
Mol Weight 389.47 g/mol
Molecular Formula C19H23N3O4S
Exact Mass 389.140927 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CgWWSufeWAO
Name 1-(2,4-dimethylphenyl)-4-(2-methyl-5-nitro-phenyl)sulfonyl-piperazine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H23N3O4S
InChI InChI=1S/C19H23N3O4S/c1-14-4-7-18(16(3)12-14)20-8-10-21(11-9-20)27(25,26)19-13-17(22(23)24)6-5-15(19)2/h4-7,12-13H,8-11H2,1-3H3
InChIKey IJAZNNBMXGGMBP-UHFFFAOYSA-N
Molecular Weight 389.470 g/mol
SMILES Cc1cc(c(N2CCN(S(c3cc(N(=O)=O)ccc3C)(=O)=O)CC2)cc1)C
SPLASH splash10-000i-1902000000-e615e9c5f5895f7c8b8f
Wiley ID 1444592