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2-Chloro-4-(4'-cyanobenzyl)-nitrobenzene
SpectraBase Compound ID INtOSIdvl2J
InChI InChI=1S/C14H9ClN2O2/c15-13-8-12(5-6-14(13)17(18)19)7-10-1-3-11(9-16)4-2-10/h1-6,8H,7H2
InChIKey PKJGEMAMWDAHFW-UHFFFAOYSA-N
Mol Weight 272.69 g/mol
Molecular Formula C14H9ClN2O2
Exact Mass 272.035255 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8KJGJLR7qeP
Name 2-Chloro-4-(4'-cyanobenzyl)-nitrobenzene
Alternate Name(s) 4-(3-Chloro-4-nitrobenzyl)benzonitrile
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Formula C14H9ClN2O2
InChI InChI=1S/C14H9ClN2O2/c15-13-8-12(5-6-14(13)17(18)19)7-10-1-3-11(9-16)4-2-10/h1-6,8H,7H2
InChIKey PKJGEMAMWDAHFW-UHFFFAOYSA-N
Molecular Weight 272.691 g/mol
SMILES c1(c(cc(cc1)Cc1ccc(cc1)C#N)Cl)[N+](=O)[O-]
SPLASH splash10-00dl-0490000000-250477fea4492abc5d10
Source of Spectrum ASC-361-SM6-4c4
Wiley ID 1814085