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1-(2,4-dimethylphenyl)-4-(3-nitrophenyl)sulfonyl-piperazine
SpectraBase Compound ID BYdGQPgZlbY
InChI InChI=1S/C18H21N3O4S/c1-14-6-7-18(15(2)12-14)19-8-10-20(11-9-19)26(24,25)17-5-3-4-16(13-17)21(22)23/h3-7,12-13H,8-11H2,1-2H3
InChIKey UOSAPIIMYKPWHI-UHFFFAOYSA-N
Mol Weight 375.44 g/mol
Molecular Formula C18H21N3O4S
Exact Mass 375.125277 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7rYHzoTKh8A
Name 1-(2,4-dimethylphenyl)-4-(3-nitrophenyl)sulfonyl-piperazine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21N3O4S
InChI InChI=1S/C18H21N3O4S/c1-14-6-7-18(15(2)12-14)19-8-10-20(11-9-19)26(24,25)17-5-3-4-16(13-17)21(22)23/h3-7,12-13H,8-11H2,1-2H3
InChIKey UOSAPIIMYKPWHI-UHFFFAOYSA-N
Molecular Weight 375.443 g/mol
SMILES Cc1cc(c(N2CCN(S(c3cc(N(=O)=O)ccc3)(=O)=O)CC2)cc1)C
SPLASH splash10-052r-8900000000-c6d24804517f9aeaea4d
Wiley ID 1511422