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N-[2-[2-[2-(2-acetamido-5-methoxy-phenyl)sulfanylethyldisulfanyl]ethylsulfanyl]-4-methoxy-phenyl]acetamide
SpectraBase Compound ID 1dECvbHiDhZ
InChI InChI=1S/C22H28N2O4S4/c1-15(25)23-19-7-5-17(27-3)13-21(19)29-9-11-31-32-12-10-30-22-14-18(28-4)6-8-20(22)24-16(2)26/h5-8,13-14H,9-12H2,1-4H3,(H,23,25)(H,24,26)
InChIKey BPPJPICWWILXJJ-UHFFFAOYSA-N
Mol Weight 512.7 g/mol
Molecular Formula C22H28N2O4S4
Exact Mass 512.093192 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KtiLQL2657c
Name N-[2-[2-[2-(2-acetamido-5-methoxy-phenyl)sulfanylethyldisulfanyl]ethylsulfanyl]-4-methoxy-phenyl]acetamide
Alternate Name(s) N-[2-[2-[2-(2-acetamido-5-methoxy-phenyl)sulfanylethyldisulfanyl]ethylsulfanyl]-4-methoxy-phenyl]ethanamide N-[2-[2-[2-[(2-acetamido-5-methoxy-phenyl)thio]ethyldisulfanyl]ethylthio]-4-methoxy-phenyl]acetamide N-[2-[2-[2-[(2-acetamido-5-methoxyphenyl)thio]ethyldisulfanyl]ethylthio]-4-methoxyphenyl]acetamide
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H28N2O4S4
InChI InChI=1S/C22H28N2O4S4/c1-15(25)23-19-7-5-17(27-3)13-21(19)29-9-11-31-32-12-10-30-22-14-18(28-4)6-8-20(22)24-16(2)26/h5-8,13-14H,9-12H2,1-4H3,(H,23,25)(H,24,26)
InChIKey BPPJPICWWILXJJ-UHFFFAOYSA-N
Molecular Weight 512.716 g/mol
SMILES N(c1c(SCCSSCCSc2c(NC(=O)C)ccc(c2)OC)cc(cc1)OC)C(=O)C
SPLASH splash10-0002-0900020000-e73355772196d0c000d9
Source of Spectrum KC-0-344-14
Wiley ID 827489