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5-cyano-2,4-dimethyl-valeric acid methyl ester
SpectraBase Compound ID Jn2XD5r5JyN
InChI InChI=1S/C9H15NO2/c1-7(4-5-10)6-8(2)9(11)12-3/h7-8H,4,6H2,1-3H3
InChIKey RDJBZIQIKIHRRO-UHFFFAOYSA-N
Mol Weight 169.22 g/mol
Molecular Formula C9H15NO2
Exact Mass 169.110279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I4epBSiF9aW
Name 5-cyano-2,4-dimethyl-valeric acid methyl ester
Alternate Name(s) 5-cyano-2,4-dimethylpentanoic acid methyl ester Methyl 5-cyano-2,4-dimethyl-pentanoate
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Formula C9H15NO2
InChI InChI=1S/C9H15NO2/c1-7(4-5-10)6-8(2)9(11)12-3/h7-8H,4,6H2,1-3H3
InChIKey RDJBZIQIKIHRRO-UHFFFAOYSA-N
Molecular Weight 169.224 g/mol
SMILES C(=O)(C(CC(CC#N)C)C)OC
SPLASH splash10-00kr-9100000000-a7359203e295448a56f3
Wiley ID 1487272