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N-Hexyl-2-benzyl-4-methyl-3-(p-tolylsulfonyl)pentamide
SpectraBase Compound ID 2B1F5HZOSHm
InChI InChI=1S/C26H37NO3S/c1-5-6-7-11-18-27-26(28)24(19-22-12-9-8-10-13-22)25(20(2)3)31(29,30)23-16-14-21(4)15-17-23/h8-10,12-17,20,24-25H,5-7,11,18-19H2,1-4H3,(H,27,28)
InChIKey VCEWVLROYIZIED-UHFFFAOYSA-N
Mol Weight 443.6 g/mol
Molecular Formula C26H37NO3S
Exact Mass 443.249415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 73SbK2IKcr3
Name N-Hexyl-2-benzyl-4-methyl-3-(p-tolylsulfonyl)pentamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H37NO3S
InChI InChI=1S/C26H37NO3S/c1-5-6-7-11-18-27-26(28)24(19-22-12-9-8-10-13-22)25(20(2)3)31(29,30)23-16-14-21(4)15-17-23/h8-10,12-17,20,24-25H,5-7,11,18-19H2,1-4H3,(H,27,28)
InChIKey VCEWVLROYIZIED-UHFFFAOYSA-N
Molecular Weight 443.646 g/mol
SMILES N(C(C(C(S(c1ccc(cc1)C)(=O)=O)C(C)C)Cc1ccccc1)=O)CCCCCC
SPLASH splash10-001i-0090000000-c87e9f664c7a9f8c8f90
Source of Spectrum AJ-66-2343-3
Synonyms 2-Benzyl-N-hexyl-4-methyl-3-[(4-methylphenyl)sulfonyl]pentanamide
Wiley ID 772181