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5-[5-(3,5-dicarbethoxy-4-propyl-1H-pyrrol-2-yl)-2-furyl]-3-propyl-1H-pyrrole-2,4-dicarboxylic acid diethyl ester
SpectraBase Compound ID zkhWQFjIpK
InChI InChI=1S/C30H38N2O9/c1-7-13-17-21(27(33)37-9-3)25(31-23(17)29(35)39-11-5)19-15-16-20(41-19)26-22(28(34)38-10-4)18(14-8-2)24(32-26)30(36)40-12-6/h15-16,31-32H,7-14H2,1-6H3
InChIKey DEHAKLQHVONSFP-UHFFFAOYSA-N
Mol Weight 570.6 g/mol
Molecular Formula C30H38N2O9
Exact Mass 570.257731 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K17yFg5abcS
Name 5-[5-(3,5-dicarbethoxy-4-propyl-1H-pyrrol-2-yl)-2-furyl]-3-propyl-1H-pyrrole-2,4-dicarboxylic acid diethyl ester
Alternate Name(s) 5-[5-[3,5-bis(ethoxycarbonyl)-4-propyl-1H-pyrrol-2-yl]-2-furanyl]-3-propyl-1H-pyrrole-2,4-dicarboxylic acid diethyl ester Diethyl 5-[5-[3,5-bis(ethoxycarbonyl)-4-propyl-1H-pyrrol-2-yl]furan-2-yl]-3-propyl-1H-pyrrole-2,4-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H38N2O9
InChI InChI=1S/C30H38N2O9/c1-7-13-17-21(27(33)37-9-3)25(31-23(17)29(35)39-11-5)19-15-16-20(41-19)26-22(28(34)38-10-4)18(14-8-2)24(32-26)30(36)40-12-6/h15-16,31-32H,7-14H2,1-6H3
InChIKey DEHAKLQHVONSFP-UHFFFAOYSA-N
Molecular Weight 570.639 g/mol
SMILES [nH]1c(c(c(c1-c1oc(-c2c(c(c([nH]2)C(=O)OCC)CCC)C(=O)OCC)cc1)C(=O)OCC)CCC)C(=O)OCC
SPLASH splash10-00di-0000090000-696ceb2cca3d27fd65ce
Source of Spectrum Y-30-1488-3
Wiley ID 761159