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tert-Butyl 2,5-Diethyl 3-(4-Chlorophenyl)pyrrole-1,2,5-tricarboxylate
SpectraBase Compound ID BBePgPZHMg3
InChI InChI=1S/C21H24ClNO6/c1-6-27-18(24)16-12-15(13-8-10-14(22)11-9-13)17(19(25)28-7-2)23(16)20(26)29-21(3,4)5/h8-12H,6-7H2,1-5H3
InChIKey UQVJBIQSXGNGHY-UHFFFAOYSA-N
Mol Weight 421.88 g/mol
Molecular Formula C21H24ClNO6
Exact Mass 421.129215 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BGZHcr3wzTH
Name tert-Butyl 2,5-Diethyl 3-(4-Chlorophenyl)pyrrole-1,2,5-tricarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24ClNO6
InChI InChI=1S/C21H24ClNO6/c1-6-27-18(24)16-12-15(13-8-10-14(22)11-9-13)17(19(25)28-7-2)23(16)20(26)29-21(3,4)5/h8-12H,6-7H2,1-5H3
InChIKey UQVJBIQSXGNGHY-UHFFFAOYSA-N
Molecular Weight 421.877 g/mol
SMILES c1([n](c(cc1-c1ccc(cc1)Cl)C(=O)OCC)C(OC(C)(C)C)=O)C(=O)OCC
SPLASH splash10-00di-0029000000-3af6fe6e8ddedf355726
Source of Spectrum F4-43-1758-12c
Wiley ID 1711996