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6-Nitro-6-(oxocyclohexyl)hexanenitrile
SpectraBase Compound ID 2p6JXQ5n2HR
InChI InChI=1S/C12H18N2O3/c13-9-5-1-2-7-11(14(16)17)10-6-3-4-8-12(10)15/h10-11H,1-8H2
InChIKey CFNRMAVXRYVALV-UHFFFAOYSA-N
Mol Weight 238.29 g/mol
Molecular Formula C12H18N2O3
Exact Mass 238.131742 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AeJBxJRiXZ0
Name 6-Nitro-6-(oxocyclohexyl)hexanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18N2O3
InChI InChI=1S/C12H18N2O3/c13-9-5-1-2-7-11(14(16)17)10-6-3-4-8-12(10)15/h10-11H,1-8H2
InChIKey CFNRMAVXRYVALV-UHFFFAOYSA-N
Molecular Weight 238.287 g/mol
SMILES C(CCCCC(C1C(CCCC1)=O)N(=O)=O)#N
SPLASH splash10-05mp-9500000000-adfeb0809189e4063eb8
Source of Spectrum F-68-5855-3ic
Wiley ID 1717316