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5-(2-Fluoro-phenyl)-1-hexadecyl-3-hydroxy-4-(4-nitro-benzoyl)-1,5-dihydro-pyrrol-2-one
SpectraBase Compound ID XkHmIyAJBC
InChI InChI=1S/C33H43FN2O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-24-35-30(27-18-15-16-19-28(27)34)29(32(38)33(35)39)31(37)25-20-22-26(23-21-25)36(40)41/h15-16,18-23,30,38H,2-14,17,24H2,1H3
InChIKey JPBZRLYZTJNJFE-UHFFFAOYSA-N
Mol Weight 566.7 g/mol
Molecular Formula C33H43FN2O5
Exact Mass 566.315601 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LBirLW2NaGW
Name 5-(2-Fluoro-phenyl)-1-hexadecyl-3-hydroxy-4-(4-nitro-benzoyl)-1,5-dihydro-pyrrol-2-one
Alternate Name(s) 5-(2-Fluorophenyl)-1-hexadecyl-3-hydroxy-4-(4-nitrobenzoyl)-1,5-dihydro-2H-pyrrol-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H43FN2O5
InChI InChI=1S/C33H43FN2O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-24-35-30(27-18-15-16-19-28(27)34)29(32(38)33(35)39)31(37)25-20-22-26(23-21-25)36(40)41/h15-16,18-23,30,38H,2-14,17,24H2,1H3
InChIKey JPBZRLYZTJNJFE-UHFFFAOYSA-N
Molecular Weight 566.714 g/mol
SMILES OC=1C(N(C(C1C(c1ccc(cc1)N(=O)=O)=O)c1c(cccc1)F)CCCCCCCCCCCCCCCC)=O
SPLASH splash10-0006-9820000000-1c6caad06909d090c928
Wiley ID 1438645