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N,2-Dibenzyl-3-(p-tolylsulfonyl)butanamide
SpectraBase Compound ID 2XKpDN8Z0rv
InChI InChI=1S/C25H27NO3S/c1-19-13-15-23(16-14-19)30(28,29)20(2)24(17-21-9-5-3-6-10-21)25(27)26-18-22-11-7-4-8-12-22/h3-16,20,24H,17-18H2,1-2H3,(H,26,27)
InChIKey XVJPKUMQHMSVJR-UHFFFAOYSA-N
Mol Weight 421.56 g/mol
Molecular Formula C25H27NO3S
Exact Mass 421.171165 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ATPJIAagzMk
Name N,2-Dibenzyl-3-(p-tolylsulfonyl)butanamide
Comments Less than 3 mono-isotopic peaks
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Formula C25H27NO3S
InChI InChI=1S/C25H27NO3S/c1-19-13-15-23(16-14-19)30(28,29)20(2)24(17-21-9-5-3-6-10-21)25(27)26-18-22-11-7-4-8-12-22/h3-16,20,24H,17-18H2,1-2H3,(H,26,27)
InChIKey XVJPKUMQHMSVJR-UHFFFAOYSA-N
Molecular Weight 421.555 g/mol
SMILES N(C(C(C(C)S(=O)(=O)c1ccc(cc1)C)Cc1ccccc1)=O)Cc1ccccc1
SPLASH splash10-02t9-0040900000-a102a51338c6b7708ccd
Source of Spectrum AJ-66-2343-3
Synonyms N,2-dibenzyl-3-[(4-methylphenyl)sulfonyl]butanamide
Wiley ID 772188