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5-[N-(Ethoxycarbonyl)amino]-2-methylheptanenitrile
SpectraBase Compound ID 2G7FBlI4h0q
InChI InChI=1S/C11H20N2O2/c1-4-10(7-6-9(3)8-12)13-11(14)15-5-2/h9-10H,4-7H2,1-3H3,(H,13,14)/t9?,10-/m0/s1
InChIKey GLMLPLUIGOCXBQ-AXDSSHIGSA-N
Mol Weight 212.29 g/mol
Molecular Formula C11H20N2O2
Exact Mass 212.152478 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7vIbTobEL0S
Name 5-[N-(Ethoxycarbonyl)amino]-2-methylheptanenitrile
Alternate Name(s) ((S)-4-Cyano-1-ethyl-4-methyl-butyl)-carbamic acid ethyl ester 5-[N'-(Ethoxycarbonyl)amino]-2-methylheptanenitrile Ethyl 4-cyano-1-ethylpentylcarbamate
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Formula C11H20N2O2
InChI InChI=1S/C11H20N2O2/c1-4-10(7-6-9(3)8-12)13-11(14)15-5-2/h9-10H,4-7H2,1-3H3,(H,13,14)/t9?,10-/m0/s1
InChIKey GLMLPLUIGOCXBQ-AXDSSHIGSA-N
Molecular Weight 212.293 g/mol
SMILES N(C(=O)OCC)[C@](CCC(C#N)C)(CC)[H]
SPLASH splash10-0a5c-9400000000-7f2c9c8bace05a115271
Source of Spectrum Y4-91-265-3
Wiley ID 1550558