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Ethyl 2-(benzyl(1-methoxy-4-oxocyclohexa-2,5-dienyl)carbamoyl)pent-4-enoate
SpectraBase Compound ID DRLpnV0fjfg
InChI InChI=1S/C22H25NO5/c1-4-9-19(21(26)28-5-2)20(25)23(16-17-10-7-6-8-11-17)22(27-3)14-12-18(24)13-15-22/h4,6-8,10-15,19H,1,5,9,16H2,2-3H3
InChIKey QTGPHTOKCOMYEU-UHFFFAOYSA-N
Mol Weight 383.44 g/mol
Molecular Formula C22H25NO5
Exact Mass 383.173273 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DRs1hYSCvUV
Name Ethyl 2-(benzyl(1-methoxy-4-oxocyclohexa-2,5-dienyl)carbamoyl)pent-4-enoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H25NO5
InChI InChI=1S/C22H25NO5/c1-4-9-19(21(26)28-5-2)20(25)23(16-17-10-7-6-8-11-17)22(27-3)14-12-18(24)13-15-22/h4,6-8,10-15,19H,1,5,9,16H2,2-3H3
InChIKey QTGPHTOKCOMYEU-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol901005x
Molecular Weight 383.444 g/mol
SMILES C1(C=CC(C=C1)=O)(N(Cc1ccccc1)C(C(CC=C)C(OCC)=O)=O)OC
SPLASH splash10-074l-3920000000-8f4dfc7c1f07c62f83e6
Source of Spectrum A1-11-2820/SM12-5
Synonyms Ethyl 2-(benzyl(1-methoxy-4-oxocyclohexa-2,5-dien-1-yl)carbamoyl)pent-4-enoate
Wiley ID 1756926