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Pentanamide, N-[3-[(hexadecylsulfonyl)amino]phenyl]-2-[4-[(4-hydroxyphenyl)sulfonyl]phenoxy]-4,4-dimethyl-3-oxo-
SpectraBase Compound ID LyW0HsmIA3j
InChI InChI=1S/C41H58N2O8S2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-30-52(47,48)43-33-21-19-20-32(31-33)42-40(46)38(39(45)41(2,3)4)51-35-24-28-37(29-25-35)53(49,50)36-26-22-34(44)23-27-36/h19-29,31,38,43-44H,5-18,30H2,1-4H3,(H,42,46)
InChIKey HIFOZHWTXKCRIZ-UHFFFAOYSA-N
Mol Weight 771.0 g/mol
Molecular Formula C41H58N2O8S2
Exact Mass 770.363459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1bYY95J07s
Name Pentanamide, N-[3-[(hexadecylsulfonyl)amino]phenyl]-2-[4-[(4-hydroxyphenyl)sulfonyl]phenoxy]-4,4-dimethyl-3-oxo-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C41H58N2O8S2
InChI InChI=1S/C41H58N2O8S2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-30-52(47,48)43-33-21-19-20-32(31-33)42-40(46)38(39(45)41(2,3)4)51-35-24-28-37(29-25-35)53(49,50)36-26-22-34(44)23-27-36/h19-29,31,38,43-44H,5-18,30H2,1-4H3,(H,42,46)
InChIKey HIFOZHWTXKCRIZ-UHFFFAOYSA-N
Molecular Weight 771.041 g/mol
SMILES N(S(CCCCCCCCCCCCCCCC)(=O)=O)c1cccc(c1)NC(C(Oc1ccc(S(c2ccc(cc2)O)(=O)=O)cc1)C(=O)C(C)(C)C)=O
SPLASH splash10-052f-9200000000-a11f5131b029e6c08b73
Source of Spectrum JX-2015-4-1494
Synonyms N-(3-(hexadecylsulfonamido)phenyl)-2-(4-((4-hydroxyphenyl)sulfonyl)phenoxy)-4,4-dimethyl-3-oxopentanamide N-{3-[(hexadecylsulfonyl)amino]phenyl}-2-{4-[(4-hydroxyphenyl)sulfonyl]phenoxy}-4,4-dimethyl-3-oxopentanamide N-[3-(hexadecylsulfonylamino)phenyl]-2-[4-(4-hydroxyphenyl)sulfonylphenoxy]-4,4-dimethyl-3-oxopentanamide N-[3-(hexadecylsulfonylamino)phenyl]-2-[4-(4-hydroxyphenyl)sulfonylphenoxy]-4,4-dimethyl-3-oxo-pentanamide N-[3-(hexadecylsulfonylamino)phenyl]-2-[4-(4-hydroxyphenyl)sulfonylphenoxy]-4,4-dimethyl-3-oxidanylidene-pentanamide
Wiley ID 1726877