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3-(1-Nitroethyl)cyclohexanone
SpectraBase Compound ID BW4UqiqJ8xJ
InChI InChI=1S/C8H13NO3/c1-6(9(11)12)7-3-2-4-8(10)5-7/h6-7H,2-5H2,1H3
InChIKey UNJFNXOQUDPIMG-UHFFFAOYSA-N
Mol Weight 171.2 g/mol
Molecular Formula C8H13NO3
Exact Mass 171.089543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1GaTRAm1Oi
Name 3-(1-Nitroethyl)cyclohexanone
Alternate Name(s) 3-(1-nitroethyl)-1-cyclohexanone 3-(1-nitroethyl)cyclohexan-1-one
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Formula C8H13NO3
InChI InChI=1S/C8H13NO3/c1-6(9(11)12)7-3-2-4-8(10)5-7/h6-7H,2-5H2,1H3
InChIKey UNJFNXOQUDPIMG-UHFFFAOYSA-N
Molecular Weight 171.196 g/mol
SMILES C(N(=O)=O)(C1CC(=O)CCC1)C
SPLASH splash10-0avr-9200000000-b1d50bd4d497f7715696
Source of Spectrum F-56-9362-3
Wiley ID 859318