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5-[(1Z)-1-(4-Cyanophenyl)-5-(2-oxo-1,3-oxazolidin-3-yl)pent-1-en-1-yl]-N,2-dimethoxy-3-methylbenzenecarboximidoyl Chloride
SpectraBase Compound ID HSyLiVnZHI3
InChI InChI=1S/C25H26ClN3O4/c1-17-14-20(15-22(23(17)31-2)24(26)28-32-3)21(19-9-7-18(16-27)8-10-19)6-4-5-11-29-12-13-33-25(29)30/h6-10,14-15H,4-5,11-13H2,1-3H3/b21-6-,28-24?
InChIKey DHGCXTCAJDQLKY-DCKGRBRFSA-N
Mol Weight 467.95 g/mol
Molecular Formula C25H26ClN3O4
Exact Mass 467.161184 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5tOgI3tvoW6
Name 5-[(1Z)-1-(4-Cyanophenyl)-5-(2-oxo-1,3-oxazolidin-3-yl)pent-1-en-1-yl]-N,2-dimethoxy-3-methylbenzenecarboximidoyl Chloride
Appearance Clear oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H26ClN3O4
InChI InChI=1S/C25H26ClN3O4/c1-17-14-20(15-22(23(17)31-2)24(26)28-32-3)21(19-9-7-18(16-27)8-10-19)6-4-5-11-29-12-13-33-25(29)30/h6-10,14-15H,4-5,11-13H2,1-3H3/b21-6-,28-24?
InChIKey DHGCXTCAJDQLKY-DCKGRBRFSA-N
Ionization Type EI
Molecular Weight 467.953 g/mol
Reported Formula C25H26(35)ClN3O4
SMILES c1c(c(c(cc1\C(=C/CCCN1CCOC1=O)c1ccc(cc1)C#N)C)OC)C(Cl)=NOC
SPLASH splash10-0ik9-2529300000-daf65d55f74bc2a2d471
Source of Spectrum US20170267667A1
Wiley ID 1866080