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1-[3-fluoranyl-4-[4-(5-nitro-2-pyrrolidin-1-yl-phenyl)carbonylpiperazin-1-yl]phenyl]propan-1-one
SpectraBase Compound ID 1bpkFIRO8tw
InChI InChI=1S/C24H27FN4O4/c1-2-23(30)17-5-7-22(20(25)15-17)27-11-13-28(14-12-27)24(31)19-16-18(29(32)33)6-8-21(19)26-9-3-4-10-26/h5-8,15-16H,2-4,9-14H2,1H3
InChIKey NGZOCXDYNQRWLP-UHFFFAOYSA-N
Mol Weight 454.5 g/mol
Molecular Formula C24H27FN4O4
Exact Mass 454.201634 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Zmvsw1hc8
Name 1-[3-fluoranyl-4-[4-(5-nitro-2-pyrrolidin-1-yl-phenyl)carbonylpiperazin-1-yl]phenyl]propan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H27FN4O4
InChI InChI=1S/C24H27FN4O4/c1-2-23(30)17-5-7-22(20(25)15-17)27-11-13-28(14-12-27)24(31)19-16-18(29(32)33)6-8-21(19)26-9-3-4-10-26/h5-8,15-16H,2-4,9-14H2,1H3
InChIKey NGZOCXDYNQRWLP-UHFFFAOYSA-N
Molecular Weight 454.502 g/mol
SMILES c1(C(N2CCN(CC2)c2c(cc(cc2)C(=O)CC)F)=O)c(N2CCCC2)ccc(N(=O)=O)c1
SPLASH splash10-0a4i-8980000000-9d74394b48b9725430af
Synonyms 1-[3-fluoro-4-[4-(5-nitro-2-pyrrolidin-1-yl-benzoyl)piperazin-1-yl]phenyl]propan-1-one 1-[3-fluoro-4-[4-(5-nitro-2-pyrrolidino-benzoyl)piperazino]phenyl]propan-1-one 1-[3-fluoro-4-[4-[[5-nitro-2-(1-pyrrolidinyl)phenyl]-oxomethyl]-1-piperazinyl]phenyl]-1-propanone
Wiley ID 1458721