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3,3'-[5-(2,4-Dichlorobenzylamino)uracil-1,3-diyl]dipropanenitrile
SpectraBase Compound ID DAckdya6bNv
InChI InChI=1S/C17H15Cl2N5O2/c18-13-4-3-12(14(19)9-13)10-22-15-11-23(7-1-5-20)17(26)24(16(15)25)8-2-6-21/h3-4,9,11,22H,1-2,7-8,10H2
InChIKey KOFGDBVIRDFZOK-UHFFFAOYSA-N
Mol Weight 392.25 g/mol
Molecular Formula C17H15Cl2N5O2
Exact Mass 391.06028 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GqNFkrWRpyi
Name 3,3'-[5-(2,4-Dichlorobenzylamino)uracil-1,3-diyl]dipropanenitrile
Comments Less than 3 mono-isotopic peaks
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Formula C17H15Cl2N5O2
InChI InChI=1S/C17H15Cl2N5O2/c18-13-4-3-12(14(19)9-13)10-22-15-11-23(7-1-5-20)17(26)24(16(15)25)8-2-6-21/h3-4,9,11,22H,1-2,7-8,10H2
InChIKey KOFGDBVIRDFZOK-UHFFFAOYSA-N
Molecular Weight 392.246 g/mol
SMILES N(C=1C(N(C(N(CCC#N)C1)=O)CCC#N)=O)Cc1c(cc(cc1)Cl)Cl
SPLASH splash10-0006-0039000000-2f7868154c9ada7e6cd6
Source of Spectrum F4-43-608-15c
Wiley ID 1675232