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N-Hexyl-2-[1-(p-tolylsulfonyl)ethyl]heptanamide
SpectraBase Compound ID BkDQG2lRvRY
InChI InChI=1S/C22H37NO3S/c1-5-7-9-11-17-23-22(24)21(12-10-8-6-2)19(4)27(25,26)20-15-13-18(3)14-16-20/h13-16,19,21H,5-12,17H2,1-4H3,(H,23,24)
InChIKey KXUYSIPZQYAEQK-UHFFFAOYSA-N
Mol Weight 395.6 g/mol
Molecular Formula C22H37NO3S
Exact Mass 395.249415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AXqIpJ4o6Ic
Name N-Hexyl-2-[1-(p-tolylsulfonyl)ethyl]heptanamide
Alternate Name(s) N-hexyl-2-{1-[(4-methylphenyl)sulfonyl]ethyl}heptanamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H37NO3S
InChI InChI=1S/C22H37NO3S/c1-5-7-9-11-17-23-22(24)21(12-10-8-6-2)19(4)27(25,26)20-15-13-18(3)14-16-20/h13-16,19,21H,5-12,17H2,1-4H3,(H,23,24)
InChIKey KXUYSIPZQYAEQK-UHFFFAOYSA-N
Molecular Weight 395.602 g/mol
SMILES N(C(C(CCCCC)C(C)S(=O)(=O)c1ccc(cc1)C)=O)CCCCCC
SPLASH splash10-00di-0950000000-f284fe7bb38086912690
Source of Spectrum AJ-66-2343-3
Wiley ID 772185