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1,6-Diazecine, 1,2,3,4,5,6,7,10-octahydro-1,6-bis[(4-methylphenyl)sulfonyl]-, (Z)-
SpectraBase Compound ID 6lCnN1o8ECs
InChI InChI=1S/C22H28N2O4S2/c1-19-7-11-21(12-8-19)29(25,26)23-15-3-5-17-24(18-6-4-16-23)30(27,28)22-13-9-20(2)10-14-22/h3,5,7-14H,4,6,15-18H2,1-2H3/b5-3-
InChIKey MCAVEGGSZIYEJS-HYXAFXHYSA-N
Mol Weight 448.6 g/mol
Molecular Formula C22H28N2O4S2
Exact Mass 448.14905 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bb3lsHiSWNH
Name 1,6-Diazecine, 1,2,3,4,5,6,7,10-octahydro-1,6-bis[(4-methylphenyl)sulfonyl]-, (Z)-
CAS Registry Number 126544-45-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H28N2O4S2
InChI InChI=1S/C22H28N2O4S2/c1-19-7-11-21(12-8-19)29(25,26)23-15-3-5-17-24(18-6-4-16-23)30(27,28)22-13-9-20(2)10-14-22/h3,5,7-14H,4,6,15-18H2,1-2H3/b5-3-
InChIKey MCAVEGGSZIYEJS-HYXAFXHYSA-N
Molecular Weight 448.596 g/mol
SMILES C1N(S(c2ccc(cc2)C)(=O)=O)CCCCN(C\C=C/1)S(c1ccc(cc1)C)(=O)=O
SPLASH splash10-0006-9000000000-58545c9194ddc5d5cd7b
Source of Spectrum J-55-3390-6
Synonyms 1,2,3,4,5,6,7,10-Octahydro-1,6-bis((4-methoxyphenyl)sulfonyl)-1,6-diazecine 1,6-bis[(4-methylphenyl)sulfonyl]-1,2,3,4,5,6,7,10-octahydro-1,6-diazecine
Wiley ID 1387097