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(3R)-3-(1-Methylethenyl)-6-oxoheptanenitrile
SpectraBase Compound ID H61KNzGi6dY
InChI InChI=1S/C10H15NO/c1-8(2)10(6-7-11)5-4-9(3)12/h10H,1,4-6H2,2-3H3/t10-/m1/s1
InChIKey DTWKKDUYCIPQFZ-SNVBAGLBSA-N
Mol Weight 165.24 g/mol
Molecular Formula C10H15NO
Exact Mass 165.115364 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4iKB5Yui5Op
Name (3R)-3-(1-Methylethenyl)-6-oxoheptanenitrile
Alternate Name(s) (3R)-3-(3-ketobutyl)-4-methyl-pent-4-enenitrile (3R)-3-isopropenyl-6-oxo-heptanenitrile (3R)-6-oxidanylidene-3-prop-1-en-2-yl-heptanenitrile (3R)-6-oxo-3-prop-1-en-2-ylheptanenitrile
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Formula C10H15NO
InChI InChI=1S/C10H15NO/c1-8(2)10(6-7-11)5-4-9(3)12/h10H,1,4-6H2,2-3H3/t10-/m1/s1
InChIKey DTWKKDUYCIPQFZ-SNVBAGLBSA-N
Molecular Weight 165.236 g/mol
SMILES C(C[C@@](CCC(C)=O)(C(=C)C)[H])#N
SPLASH splash10-0a4i-3900000000-2212f5e154d2a487328f
Source of Spectrum F-69-8442-26
Wiley ID 1595861