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3-(2-Benzyloxycarbonylethyl)-4-methyl-1H-pyrrole-2,5-dicarboxylic acid 2-tert-butyl ester 5-ethyl ester
SpectraBase Compound ID 2eEkqLeOkdL
InChI InChI=1S/C23H29NO6/c1-6-28-21(26)19-15(2)17(20(24-19)22(27)30-23(3,4)5)12-13-18(25)29-14-16-10-8-7-9-11-16/h7-11,24H,6,12-14H2,1-5H3
InChIKey UARNXVVHXLDNHU-UHFFFAOYSA-N
Mol Weight 415.49 g/mol
Molecular Formula C23H29NO6
Exact Mass 415.199488 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6aENoaFzmLP
Name 3-(2-Benzyloxycarbonylethyl)-4-methyl-1H-pyrrole-2,5-dicarboxylic acid 2-tert-butyl ester 5-ethyl ester
Alternate Name(s) 2-tert-Butyl 5-ethyl 3-[3-(benzyloxy)-3-oxopropyl]-4-methyl-1H-pyrrole-2,5-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H29NO6
InChI InChI=1S/C23H29NO6/c1-6-28-21(26)19-15(2)17(20(24-19)22(27)30-23(3,4)5)12-13-18(25)29-14-16-10-8-7-9-11-16/h7-11,24H,6,12-14H2,1-5H3
InChIKey UARNXVVHXLDNHU-UHFFFAOYSA-N
Molecular Weight 415.486 g/mol
SMILES [nH]1c(c(c(c1C(=O)OC(C)(C)C)CCC(=O)OCc1ccccc1)C)C(=O)OCC
SPLASH splash10-0gbc-4191000000-b4488c644121950ec19b
Source of Spectrum SO-0-93-1
Wiley ID 1611812