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1H-1,5-Diazonine, 2,3,4,5,6,9-hexahydro-1,5-bis[(4-methylphenyl)sulfonyl]-, (Z)-
SpectraBase Compound ID 1sWQlqyTrQH
InChI InChI=1S/C21H26N2O4S2/c1-18-6-10-20(11-7-18)28(24,25)22-14-3-4-15-23(17-5-16-22)29(26,27)21-12-8-19(2)9-13-21/h3-4,6-13H,5,14-17H2,1-2H3/b4-3-
InChIKey OQHMZJHKPKNRDC-ARJAWSKDSA-N
Mol Weight 434.57 g/mol
Molecular Formula C21H26N2O4S2
Exact Mass 434.1334 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7ertfKCOCjK
Name 1H-1,5-Diazonine, 2,3,4,5,6,9-hexahydro-1,5-bis[(4-methylphenyl)sulfonyl]-, (Z)-
CAS Registry Number 126544-44-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26N2O4S2
InChI InChI=1S/C21H26N2O4S2/c1-18-6-10-20(11-7-18)28(24,25)22-14-3-4-15-23(17-5-16-22)29(26,27)21-12-8-19(2)9-13-21/h3-4,6-13H,5,14-17H2,1-2H3/b4-3-
InChIKey OQHMZJHKPKNRDC-ARJAWSKDSA-N
Molecular Weight 434.569 g/mol
SMILES C1N(S(c2ccc(cc2)C)(=O)=O)CCCN(C\C=C/1)S(c1ccc(cc1)C)(=O)=O
SPLASH splash10-004i-1190000000-9cb513504c397372ec3b
Source of Spectrum J-55-3390-6
Synonyms 1,5-bis[(4-methylphenyl)sulfonyl]-2,3,4,5,6,9-hexahydro-1H-1,5-diazonine 2,3,4,5,6,9-Hexahydro-1,5-bis((4-methoxyphenyl)sulfonyl)-1H-1,5-diazonine
Wiley ID 1382877