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Ethyl 4-benzoyl-1-butyl-5-methyl-2-propyl-1H-pyrrole-3-carboxylate
SpectraBase Compound ID Div7VG7b8t7
InChI InChI=1S/C22H29NO3/c1-5-8-15-23-16(4)19(21(24)17-13-10-9-11-14-17)20(18(23)12-6-2)22(25)26-7-3/h9-11,13-14H,5-8,12,15H2,1-4H3
InChIKey HPSOTQTUOFAJNL-UHFFFAOYSA-N
Mol Weight 355.48 g/mol
Molecular Formula C22H29NO3
Exact Mass 355.214744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H7krmLl82Yy
Name Ethyl 4-benzoyl-1-butyl-5-methyl-2-propyl-1H-pyrrole-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H29NO3
InChI InChI=1S/C22H29NO3/c1-5-8-15-23-16(4)19(21(24)17-13-10-9-11-14-17)20(18(23)12-6-2)22(25)26-7-3/h9-11,13-14H,5-8,12,15H2,1-4H3
InChIKey HPSOTQTUOFAJNL-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200900379
Molecular Weight 355.478 g/mol
SMILES c1(c(c(c(CCC)[n]1CCCC)C(OCC)=O)C(=O)c1ccccc1)C
SPLASH splash10-0a4l-2079000000-5b4f9e000be47285df31
Source of Spectrum ASC-351-2063/SM7-3ed
Wiley ID 1763390