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3-Benzoyl-2,4-diphenyl-1-pyrrolecarboxylic acid tert-butyl ester
SpectraBase Compound ID Dsf4ufE2ox9
InChI InChI=1S/C28H25NO3/c1-28(2,3)32-27(31)29-19-23(20-13-7-4-8-14-20)24(25(29)21-15-9-5-10-16-21)26(30)22-17-11-6-12-18-22/h4-19H,1-3H3
InChIKey WKJOGAYJDFQHRE-UHFFFAOYSA-N
Mol Weight 423.51 g/mol
Molecular Formula C28H25NO3
Exact Mass 423.183444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1dqjjVIBii
Name 3-Benzoyl-2,4-diphenyl-1-pyrrolecarboxylic acid tert-butyl ester
Alternate Name(s) 3-Benzoyl-2,4-diphenyl-pyrrole-1-carboxylic acid tert-butyl ester tert-Butyl 2,4-diphenyl-3-(phenylcarbonyl)pyrrole-1-carboxylate tert-Butyl 3-benzoyl-2,4-diphenyl-pyrrole-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H25NO3
InChI InChI=1S/C28H25NO3/c1-28(2,3)32-27(31)29-19-23(20-13-7-4-8-14-20)24(25(29)21-15-9-5-10-16-21)26(30)22-17-11-6-12-18-22/h4-19H,1-3H3
InChIKey WKJOGAYJDFQHRE-UHFFFAOYSA-N
Molecular Weight 423.512 g/mol
SMILES c1([n](cc(c1C(=O)c1ccccc1)-c1ccccc1)C(OC(C)(C)C)=O)-c1ccccc1
SPLASH splash10-00di-2139100000-36dbc2ef87ff2d59d7f8
Source of Spectrum J-63-5337-11
Wiley ID 1379008