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3,4,5-Tri-tert-butyl-2-phenylcarbamoyl-2H-pyrrole-2-carboxylic acid ethyl ester
SpectraBase Compound ID AydtK9ZZHU7
InChI InChI=1S/C26H38N2O3/c1-11-31-22(30)26(21(29)27-17-15-13-12-14-16-17)19(24(5,6)7)18(23(2,3)4)20(28-26)25(8,9)10/h12-16H,11H2,1-10H3,(H,27,29)
InChIKey UFRXPXXDSZNOLS-UHFFFAOYSA-N
Mol Weight 426.6 g/mol
Molecular Formula C26H38N2O3
Exact Mass 426.288243 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4VC1vXnweea
Name 3,4,5-Tri-tert-butyl-2-phenylcarbamoyl-2H-pyrrole-2-carboxylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H38N2O3
InChI InChI=1S/C26H38N2O3/c1-11-31-22(30)26(21(29)27-17-15-13-12-14-16-17)19(24(5,6)7)18(23(2,3)4)20(28-26)25(8,9)10/h12-16H,11H2,1-10H3,(H,27,29)
InChIKey UFRXPXXDSZNOLS-UHFFFAOYSA-N
Molecular Weight 426.601 g/mol
SMILES N(C(C1(C(=C(C(C)(C)C)C(=N1)C(C)(C)C)C(C)(C)C)C(=O)OCC)=O)c1ccccc1
SPLASH splash10-0aor-7019100000-af9de1ec8254330b9973
Source of Spectrum AC-134-934-18
Synonyms 2-(Ethoxycarbonyl)-2-[(phenylamino)carbonyl]-3,4,5-tris(t-butyl)-2H-pyrazole 2-(Ethoxycarbonyl)-2-[(phenylamino)carbonyl]-3,4,5-tris(t-butyl)-2H-pyrrole Ethyl 2-(anilinocarbonyl)-3,4,5-tritert-butyl-2H-pyrrole-2-carboxylate
Wiley ID 812461