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3',5'-Dimethylbenzyl-2,4,6-tricyanobenzene
SpectraBase Compound ID FfFB9N3NEU4
InChI InChI=1S/C18H13N3/c1-12-3-13(2)5-14(4-12)8-18-16(10-20)6-15(9-19)7-17(18)11-21/h3-7H,8H2,1-2H3
InChIKey IONDAYXPJBDCEF-UHFFFAOYSA-N
Mol Weight 271.32 g/mol
Molecular Formula C18H13N3
Exact Mass 271.110947 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GvQLlGPTaSR
Name 3',5'-Dimethylbenzyl-2,4,6-tricyanobenzene
Alternate Name(s) 2-(3,5-dimethylbenzyl)-1,3,5-benzenetricarbonitrile
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Formula C18H13N3
InChI InChI=1S/C18H13N3/c1-12-3-13(2)5-14(4-12)8-18-16(10-20)6-15(9-19)7-17(18)11-21/h3-7H,8H2,1-2H3
InChIKey IONDAYXPJBDCEF-UHFFFAOYSA-N
Molecular Weight 271.323 g/mol
SMILES c1(c(C#N)cc(C#N)cc1C#N)Cc1cc(C)cc(c1)C
SPLASH splash10-00di-0090000000-822978f1e5d63ec976ea
Source of Spectrum KC-1990-1337-3
Wiley ID 1275474