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1-Pentanesulfonamide, N-[4-[3-[4-[bis(2-fluoroethyl)amino]phenyl]-2-cyano-1-oxo-2-propen-1-yl]phenyl]-
SpectraBase Compound ID 8eC3yuvz71H
InChI InChI=1S/C25H29F2N3O3S/c1-2-3-4-17-34(32,33)29-23-9-7-21(8-10-23)25(31)22(19-28)18-20-5-11-24(12-6-20)30(15-13-26)16-14-27/h5-12,18,29H,2-4,13-17H2,1H3/b22-18-
InChIKey XOYZKGQQADQHIN-PYCFMQQDSA-N
Mol Weight 489.58 g/mol
Molecular Formula C25H29F2N3O3S
Exact Mass 489.189769 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID INgFYznNwe7
Name 1-Pentanesulfonamide, N-[4-[3-[4-[bis(2-fluoroethyl)amino]phenyl]-2-cyano-1-oxo-2-propen-1-yl]phenyl]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H29F2N3O3S
InChI InChI=1S/C25H29F2N3O3S/c1-2-3-4-17-34(32,33)29-23-9-7-21(8-10-23)25(31)22(19-28)18-20-5-11-24(12-6-20)30(15-13-26)16-14-27/h5-12,18,29H,2-4,13-17H2,1H3/b22-18-
InChIKey XOYZKGQQADQHIN-PYCFMQQDSA-N
Molecular Weight 489.582 g/mol
SMILES N(S(CCCCC)(=O)=O)c1ccc(cc1)C(=O)\C(=C/c1ccc(cc1)N(CCF)CCF)C#N
SPLASH splash10-0a4i-5412900000-fd2432104b38def5b345
Source of Spectrum JX-2015-4-882
Synonyms N-(4-(3-(4-(bis(2-fluoroethyl)amino)phenyl)-2-cyanoacryloyl)phenyl)pentane-1-sulfonamide N-[4-[3-[4-[bis(2-fluoroethyl)amino]phenyl]-2-cyano-1-oxoprop-2-enyl]phenyl]-1-pentanesulfonamide N-[4-[3-[4-[bis(2-fluoroethyl)amino]phenyl]-2-cyanoprop-2-enoyl]phenyl]pentane-1-sulfonamide N-[4-[3-[4-[bis(2-fluoroethyl)amino]phenyl]-2-cyano-prop-2-enoyl]phenyl]pentane-1-sulfonamide N-[4-[3-[4-[bis(2-fluoranylethyl)amino]phenyl]-2-cyano-prop-2-enoyl]phenyl]pentane-1-sulfonamide
Wiley ID 1726295