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4-[2-Nitro-1-(2-oxocyclohexyl)ethyl]benzonitrile
SpectraBase Compound ID 9tZX8zXfjK4
InChI InChI=1S/C15H16N2O3/c16-9-11-5-7-12(8-6-11)14(10-17(19)20)13-3-1-2-4-15(13)18/h5-8,13-14H,1-4,10H2
InChIKey CTZBRUNXOXMLOI-UHFFFAOYSA-N
Mol Weight 272.3 g/mol
Molecular Formula C15H16N2O3
Exact Mass 272.116092 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JcY45F3srIR
Name 4-[2-NITRO-1-(2-OXO-CYCLOHEXYL)ETHYL]BENZONITRILE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C15H16N2O3
InChI InChI=1S/C15H16N2O3/c16-9-11-5-7-12(8-6-11)14(10-17(19)20)13-3-1-2-4-15(13)18/h5-8,13-14H,1-4,10H2
InChIKey CTZBRUNXOXMLOI-UHFFFAOYSA-N
Molecular Weight 272.1157
SMILES c1(C#N)ccc(C(CN(=O)=O)C2C(=O)CCCC2)cc1
SPLASH splash10-005a-3920000000-c407cf69d29b518ed94a
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany