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N,N'-(m-Xylylene)-bis[N-(5'-aminopentyl)-5-[(dimethylamino)naphthalene]-1-sulfonamide]
SpectraBase Compound ID 7Qtk9XdJSEn
InChI InChI=1S/C42H56N6O4S2/c1-47(2)39-22-12-20-37-35(39)18-14-24-41(37)53(49,50)45-28-9-5-7-26-43-31-33-16-11-17-34(30-33)32-44-27-8-6-10-29-46-54(51,52)42-25-15-19-36-38(42)21-13-23-40(36)48(3)4/h11-25,30,43-46H,5-10,26-29,31-32H2,1-4H3
InChIKey CHXMBQPGUIPYRQ-UHFFFAOYSA-N
Mol Weight 773.1 g/mol
Molecular Formula C42H56N6O4S2
Exact Mass 772.380447 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5sb2jX1p5VZ
Name N,N'-(m-Xylylene)-bis[N-(5'-aminopentyl)-5-[(dimethylamino)naphthalene]-1-sulfonamide]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C42H56N6O4S2
InChI InChI=1S/C42H56N6O4S2/c1-47(2)39-22-12-20-37-35(39)18-14-24-41(37)53(49,50)45-28-9-5-7-26-43-31-33-16-11-17-34(30-33)32-44-27-8-6-10-29-46-54(51,52)42-25-15-19-36-38(42)21-13-23-40(36)48(3)4/h11-25,30,43-46H,5-10,26-29,31-32H2,1-4H3
InChIKey CHXMBQPGUIPYRQ-UHFFFAOYSA-N
Molecular Weight 773.068 g/mol
SMILES N(S(c1c2c(c(N(C)C)ccc2)ccc1)(=O)=O)CCCCCNCc1cc(CNCCCCCNS(c2c3c(c(N(C)C)ccc3)ccc2)(=O)=O)ccc1
SPLASH splash10-0f6x-9630000000-f5eb7e50b2e68215b2f7
Source of Spectrum D8-327-403-17
Synonyms 5-(dimethylamino)-N-[5-[[3-[[5-[[5-(dimethylamino)-1-naphthalenyl]sulfonylamino]pentylamino]methyl]phenyl]methylamino]pentyl]-1-naphthalenesulfonamide 5-(dimethylamino)-N-[5-[[3-[[5-[[5-(dimethylamino)-1-naphthyl]sulfonylamino]pentylamino]methyl]phenyl]methylamino]pentyl]naphthalene-1-sulfonamide 5-(dimethylamino)-N-[5-[[3-[[5-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]pentylamino]methyl]phenyl]methylamino]pentyl]naphthalene-1-sulfonamide
Wiley ID 1515272