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Syn and anti-Methyl 2-[(diphenylmethylene)amino]-3-(4-methylphenylsulfonamide)-3-(p-trifluoromethylphenyl) propanoate
SpectraBase Compound ID F2BfNXnPav6
InChI InChI=1S/C31H27F3N2O4S/c1-21-13-19-26(20-14-21)41(38,39)36-28(24-15-17-25(18-16-24)31(32,33)34)29(30(37)40-2)35-27(22-9-5-3-6-10-22)23-11-7-4-8-12-23/h3-20,28-29,36H,1-2H3
InChIKey MHBUBRZPVJMPOQ-UHFFFAOYSA-N
Mol Weight 580.62 g/mol
Molecular Formula C31H27F3N2O4S
Exact Mass 580.164363 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CIMHHljpJSf
Name Syn and anti-Methyl 2-[(diphenylmethylene)amino]-3-(4-methylphenylsulfonamide)-3-(p-trifluoromethylphenyl) propanoate
Alternate Name(s) Methyl 2-((diphenylmethylene)amino)-3-(4-methylphenylsulfonamido)-3-(4-(trifluoromethyl)phenyl)propanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H27F3N2O4S
InChI InChI=1S/C31H27F3N2O4S/c1-21-13-19-26(20-14-21)41(38,39)36-28(24-15-17-25(18-16-24)31(32,33)34)29(30(37)40-2)35-27(22-9-5-3-6-10-22)23-11-7-4-8-12-23/h3-20,28-29,36H,1-2H3
InChIKey MHBUBRZPVJMPOQ-UHFFFAOYSA-N
Molecular Weight 580.622 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)C(C(N=C(c1ccccc1)c1ccccc1)C(=O)OC)c1ccc(C(F)(F)F)cc1
SPLASH splash10-0006-9700000000-2c092bf3b0c44fc91bf1
Source of Spectrum QC-25-1651-3f
Wiley ID 1743411