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2-(1-Butyl-2-nitroallyl)cyclohexanone
SpectraBase Compound ID BMWWiZxoaYg
InChI InChI=1S/C13H21NO3/c1-3-4-7-11(10(2)14(16)17)12-8-5-6-9-13(12)15/h11-12H,2-9H2,1H3
InChIKey CKUOMATWDIWMSL-UHFFFAOYSA-N
Mol Weight 239.31 g/mol
Molecular Formula C13H21NO3
Exact Mass 239.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FXqjaK65dCl
Name 2-(1-BUTYL-2-NITROALLYL)-CYCLOHEXANONE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H21NO3
InChI InChI=1S/C13H21NO3/c1-3-4-7-11(10(2)14(16)17)12-8-5-6-9-13(12)15/h11-12H,2-9H2,1H3
InChIKey CKUOMATWDIWMSL-UHFFFAOYSA-N
Molecular Weight 239.1516
SMILES C1CCCC(=O)C1C(CCCC)C(N(=O)=O)=C
SPLASH splash10-002g-9300000000-caf5e155c3b1b5b5b308
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany