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N-[.alpha.-Cyano(4-chlorobenzyl)]-N-benzyl-2-azido-5-chlorobenzamide
SpectraBase Compound ID FPEAqNrWLgH
InChI InChI=1S/C22H15Cl2N5O/c23-17-8-6-16(7-9-17)21(13-25)29(14-15-4-2-1-3-5-15)22(30)19-12-18(24)10-11-20(19)27-28-26/h1-12,21H,14H2
InChIKey UMESGIXUJUBWEB-UHFFFAOYSA-N
Mol Weight 436.3 g/mol
Molecular Formula C22H15Cl2N5O
Exact Mass 435.065366 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Izq0EefWWaB
Name N-[.alpha.-Cyano(4-chlorobenzyl)]-N-benzyl-2-azido-5-chlorobenzamide
Comments Less than 3 mono-isotopic peaks
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Formula C22H15Cl2N5O
InChI InChI=1S/C22H15Cl2N5O/c23-17-8-6-16(7-9-17)21(13-25)29(14-15-4-2-1-3-5-15)22(30)19-12-18(24)10-11-20(19)27-28-26/h1-12,21H,14H2
InChIKey UMESGIXUJUBWEB-UHFFFAOYSA-N
Molecular Weight 436.302 g/mol
SMILES C(c1c(N=[N+]=[N-])ccc(c1)Cl)(N(C(C#N)c1ccc(cc1)Cl)Cc1ccccc1)=O
SPLASH splash10-0udi-0002900000-9cdafd197a83c881760f
Source of Spectrum H1-51-1300-2g
Wiley ID 817222