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1-Benzyl-3-isobutyl-4-(4-(isopentyloxy)phenyl)-1H-pyrrole-2,5-dione
SpectraBase Compound ID JMLem8glQC7
InChI InChI=1S/C26H31NO3/c1-18(2)14-15-30-22-12-10-21(11-13-22)24-23(16-19(3)4)25(28)27(26(24)29)17-20-8-6-5-7-9-20/h5-13,18-19H,14-17H2,1-4H3
InChIKey BNVCOFKLXOXSNU-UHFFFAOYSA-N
Mol Weight 405.54 g/mol
Molecular Formula C26H31NO3
Exact Mass 405.230394 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DYRUQDNl21z
Name 1-Benzyl-3-isobutyl-4-(4-(isopentyloxy)phenyl)-1H-pyrrole-2,5-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H31NO3
InChI InChI=1S/C26H31NO3/c1-18(2)14-15-30-22-12-10-21(11-13-22)24-23(16-19(3)4)25(28)27(26(24)29)17-20-8-6-5-7-9-20/h5-13,18-19H,14-17H2,1-4H3
InChIKey BNVCOFKLXOXSNU-UHFFFAOYSA-N
Molecular Weight 405.538 g/mol
SMILES C1(N(C(C(=C1CC(C)C)c1ccc(cc1)OCCC(C)C)=O)Cc1ccccc1)=O
SPLASH splash10-0a4i-0233900000-9a29a484ff517c546886
Source of Spectrum CMC-4-1665-13e
Wiley ID 1771535