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(S)-N-[4-[4-(Ethylheptylamino)-1-hydroxy-4-oxobutyl]phenyl]methanesulfonamide
SpectraBase Compound ID 6vfH3CNERG7
InChI InChI=1S/C20H34N2O4S/c1-4-6-7-8-9-16-22(5-2)20(24)15-14-19(23)17-10-12-18(13-11-17)21-27(3,25)26/h10-13,19,21,23H,4-9,14-16H2,1-3H3/t19-/m0/s1
InChIKey AJYZQCZASWLBGI-IBGZPJMESA-N
Mol Weight 398.6 g/mol
Molecular Formula C20H34N2O4S
Exact Mass 398.223929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7jtyEiENgTj
Name (S)-N-[4-[4-(Ethylheptylamino)-1-hydroxy-4-oxobutyl]phenyl]methanesulfonamide
Comments Less than 3 mono-isotopic peaks
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Formula C20H34N2O4S
InChI InChI=1S/C20H34N2O4S/c1-4-6-7-8-9-16-22(5-2)20(24)15-14-19(23)17-10-12-18(13-11-17)21-27(3,25)26/h10-13,19,21,23H,4-9,14-16H2,1-3H3/t19-/m0/s1
InChIKey AJYZQCZASWLBGI-IBGZPJMESA-N
Molecular Weight 398.562 g/mol
SMILES N(S(=O)(=O)C)c1ccc([C@](CCC(N(CC)CCCCCCC)=O)(O)[H])cc1
SPLASH splash10-00di-0900000000-77ae74980dcadbffddd3
Source of Spectrum QC-7-682-5
Synonyms (4S)-N-ethyl-N-heptyl-4-hydroxy-4-{4-[(methylsulfonyl)amino]phenyl}butanamide
Wiley ID 869211