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Syn and anti-Methyl 2-[(diphenylmethylene)amino]-3-(4-methylphenylsulfonamide)-3-(p-bromophenyl)propanoate
SpectraBase Compound ID 8T1cRmAYEdj
InChI InChI=1S/C30H27BrN2O4S/c1-21-13-19-26(20-14-21)38(35,36)33-28(24-15-17-25(31)18-16-24)29(30(34)37-2)32-27(22-9-5-3-6-10-22)23-11-7-4-8-12-23/h3-20,28-29,33H,1-2H3
InChIKey LNCKRMXURRXQIW-UHFFFAOYSA-N
Mol Weight 591.52 g/mol
Molecular Formula C30H27BrN2O4S
Exact Mass 590.087492 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2nt2hLN2NKA
Name Syn and anti-Methyl 2-[(diphenylmethylene)amino]-3-(4-methylphenylsulfonamide)-3-(p-bromophenyl)propanoate
Alternate Name(s) Methyl 3-(4-bromophenyl)-2-((diphenylmethylene)amino)-3-(4-methylphenylsulfonamido)propanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H27BrN2O4S
InChI InChI=1S/C30H27BrN2O4S/c1-21-13-19-26(20-14-21)38(35,36)33-28(24-15-17-25(31)18-16-24)29(30(34)37-2)32-27(22-9-5-3-6-10-22)23-11-7-4-8-12-23/h3-20,28-29,33H,1-2H3
InChIKey LNCKRMXURRXQIW-UHFFFAOYSA-N
Molecular Weight 591.520 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)C(C(N=C(c1ccccc1)c1ccccc1)C(=O)OC)c1ccc(cc1)Br
SPLASH splash10-0006-9600000000-4b8087173339fa8bb88f
Source of Spectrum QC-25-1652-3j
Wiley ID 1743407