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(3E)-4-[{2-[2-[Methoxy(phenyl)methyl]-5-(trifluoroacetyl)-1H-pyrrol-1-yl]ethyl}(methyl)amino]but-3-en-2-one
SpectraBase Compound ID 5ckTs3oGZb6
InChI InChI=1S/C21H23F3N2O3/c1-15(27)11-12-25(2)13-14-26-17(9-10-18(26)20(28)21(22,23)24)19(29-3)16-7-5-4-6-8-16/h4-12,19H,13-14H2,1-3H3/b12-11+
InChIKey UYDJLZFMAITEKI-VAWYXSNFSA-N
Mol Weight 408.42 g/mol
Molecular Formula C21H23F3N2O3
Exact Mass 408.166077 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GiK0IGbUD09
Name (3E)-4-[{2-[2-[Methoxy(phenyl)methyl]-5-(trifluoroacetyl)-1H-pyrrol-1-yl]ethyl}(methyl)amino]but-3-en-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23F3N2O3
InChI InChI=1S/C21H23F3N2O3/c1-15(27)11-12-25(2)13-14-26-17(9-10-18(26)20(28)21(22,23)24)19(29-3)16-7-5-4-6-8-16/h4-12,19H,13-14H2,1-3H3/b12-11+
InChIKey UYDJLZFMAITEKI-VAWYXSNFSA-N
Molecular Weight 408.421 g/mol
SMILES c1([n](c(cc1)C(c1ccccc1)OC)CCN(\C=C\C(=O)C)C)C(C(F)(F)F)=O
SPLASH splash10-01ox-2529200000-792763a03f1c78dab80f
Source of Spectrum F-66-5148-36
Wiley ID 1683387