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Pentane, 1-acetoxy-2-isocyano-4-methyl-
SpectraBase Compound ID DuYgQfuCjSC
InChI InChI=1S/C9H15NO2/c1-7(2)5-9(10-4)6-12-8(3)11/h7,9H,5-6H2,1-3H3
InChIKey QKYKFVLZUMSESL-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 LBRHq2XKr7s
Name Pentane, 1-acetoxy-2-isocyano-4-methyl-
Alternate Name(s) (2-isocyano-4-methyl-pentyl) acetate (2-isocyano-4-methyl-pentyl) ethanoate Acetic acid (2-isocyano-4-methyl-pentyl) ester Acetic acid (2-isocyano-4-methylpentyl) ester
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Formula C9H15NO2
InChI InChI=1S/C9H15NO2/c1-7(2)5-9(10-4)6-12-8(3)11/h7,9H,5-6H2,1-3H3
InChIKey QKYKFVLZUMSESL-UHFFFAOYSA-N
Molecular Weight 169.224 g/mol
SMILES C([N+]#[C-])(COC(C)=O)CC(C)C
SPLASH splash10-0006-9000000000-2a69f2b42d4eeba207c4
Wiley ID 1495717