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(S,E)-N-(2-benzylidene-1-(4-methoxyphenyl)-4-phenylbut-3-ynyl)-4-methyl- benzenesulfonamide
SpectraBase Compound ID 6NhDOQRalAt
InChI InChI=1S/C31H27NO3S/c1-24-13-21-30(22-14-24)36(33,34)32-31(27-17-19-29(35-2)20-18-27)28(23-26-11-7-4-8-12-26)16-15-25-9-5-3-6-10-25/h3-14,17-23,31-32H,1-2H3/b28-23+/t31-/m0/s1
InChIKey FLTNYLUKVGUGAI-SAPIAKQUSA-N
Mol Weight 493.62 g/mol
Molecular Formula C31H27NO3S
Exact Mass 493.171165 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IzOpgSh3SRQ
Name (S,E)-N-(2-benzylidene-1-(4-methoxyphenyl)-4-phenylbut-3-ynyl)-4-methyl- benzenesulfonamide
Alternate Name(s) (S,E)-N-(2-benzylidene-1-(4-methoxyphenyl)-4-phenylbut-3-yn-1-yl)-4-methylbenzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H27NO3S
InChI InChI=1S/C31H27NO3S/c1-24-13-21-30(22-14-24)36(33,34)32-31(27-17-19-29(35-2)20-18-27)28(23-26-11-7-4-8-12-26)16-15-25-9-5-3-6-10-25/h3-14,17-23,31-32H,1-2H3/b28-23+/t31-/m0/s1
InChIKey FLTNYLUKVGUGAI-SAPIAKQUSA-N
Literature Reference DOI 10.1002/adsc.200900219
Molecular Weight 493.621 g/mol
SMILES N([C@@](c1ccc(cc1)OC)(\C(C#Cc1ccccc1)=C\c1ccccc1)[H])S(=O)(c1ccc(C)cc1)=O
SPLASH splash10-0006-9281000000-e647386ed73913db629f
Source of Spectrum ASC-351-1512/SM7-7h
Wiley ID 1763260