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5-[[5-carbethoxy-3-(3-keto-3-methoxy-propyl)-4-methyl-1H-pyrrol-2-yl]methyl]-4-(3-keto-3-methoxy-propyl)-3-methyl-1H-pyrrole-2-carboxylic acid ethyl ester
SpectraBase Compound ID IfapikGXZDd
InChI InChI=1S/C25H34N2O8/c1-7-34-24(30)22-14(3)16(9-11-20(28)32-5)18(26-22)13-19-17(10-12-21(29)33-6)15(4)23(27-19)25(31)35-8-2/h26-27H,7-13H2,1-6H3
InChIKey REEDNUVIUHVDDH-UHFFFAOYSA-N
Mol Weight 490.6 g/mol
Molecular Formula C25H34N2O8
Exact Mass 490.231516 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Es1juU9TfXn
Name 5-[[5-carbethoxy-3-(3-keto-3-methoxy-propyl)-4-methyl-1H-pyrrol-2-yl]methyl]-4-(3-keto-3-methoxy-propyl)-3-methyl-1H-pyrrole-2-carboxylic acid ethyl ester
CAS Registry Number 915-70-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H34N2O8
InChI InChI=1S/C25H34N2O8/c1-7-34-24(30)22-14(3)16(9-11-20(28)32-5)18(26-22)13-19-17(10-12-21(29)33-6)15(4)23(27-19)25(31)35-8-2/h26-27H,7-13H2,1-6H3
InChIKey REEDNUVIUHVDDH-UHFFFAOYSA-N
Molecular Weight 490.553 g/mol
SMILES [nH]1c(c(c(c1Cc1c(c(c([nH]1)C(=O)OCC)C)CCC(=O)OC)CCC(=O)OC)C)C(=O)OCC
SPLASH splash10-004m-9022700000-521254dc5f57ce78124a
Source of Spectrum F-36-1837-0
Synonyms 5-[[5-ethoxycarbonyl-3-(3-methoxy-3-oxopropyl)-4-methyl-1H-pyrrol-2-yl]methyl]-4-(3-methoxy-3-oxopropyl)-3-methyl-1H-pyrrole-2-carboxylic acid ethyl ester Ethyl 5-[[5-ethoxycarbonyl-3-(3-methoxy-3-oxidanylidene-propyl)-4-methyl-1H-pyrrol-2-yl]methyl]-4-(3-methoxy-3-oxidanylidene-propyl)-3-methyl-1H-pyrrole-2-carboxylate Ethyl 5-[[5-ethoxycarbonyl-3-(3-methoxy-3-oxopropyl)-4-methyl-1H-pyrrol-2-yl]methyl]-4-(3-methoxy-3-oxopropyl)-3-methyl-1H-pyrrole-2-carboxylate
Wiley ID 1397207