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3-(N-Tosylamino)-3-phenyl-2-ethylpropanal
SpectraBase Compound ID AeSECjzdD1X
InChI InChI=1S/C18H21NO3S/c1-3-15(13-20)18(16-7-5-4-6-8-16)19-23(21,22)17-11-9-14(2)10-12-17/h4-13,15,18-19H,3H2,1-2H3
InChIKey HKSQBWZBBVEVPD-UHFFFAOYSA-N
Mol Weight 331.43 g/mol
Molecular Formula C18H21NO3S
Exact Mass 331.124215 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7djAR1b8lHj
Name 3-(N-Tosylamino)-3-phenyl-2-ethylpropanal
Alternate Name(s) N-(2-formyl-1-phenylbutyl)-4-methylbenzenesulfonamide
Comments Less than 3 mono-isotopic peaks
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Formula C18H21NO3S
InChI InChI=1S/C18H21NO3S/c1-3-15(13-20)18(16-7-5-4-6-8-16)19-23(21,22)17-11-9-14(2)10-12-17/h4-13,15,18-19H,3H2,1-2H3
InChIKey HKSQBWZBBVEVPD-UHFFFAOYSA-N
Molecular Weight 331.430 g/mol
SMILES N(C(C(C=O)CC)c1ccccc1)S(=O)(=O)c1ccc(C)cc1
SPLASH splash10-03di-0090000000-db863042fff0b5dd0d75
Source of Spectrum K-2002-1488-5
Wiley ID 1581350