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3-(1-NITRO-4-OXO-PENT-1-YL)-CYClOHEXAN-1-ONE
SpectraBase Compound ID Fb7ePTIab6S
InChI InChI=1S/C11H17NO4/c1-8(13)5-6-11(12(15)16)9-3-2-4-10(14)7-9/h9,11H,2-7H2,1H3
InChIKey KRNSDFFTNCOATI-UHFFFAOYSA-N
Mol Weight 227.26 g/mol
Molecular Formula C11H17NO4
Exact Mass 227.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CXi6B54fpSy
Name 3-(1-nitro-4-oxidanylidene-pentyl)cyclohexan-1-one
Alternate Name(s) 3-(1-nitro-4-oxo-pentyl)cyclohexanone 3-(1-nitro-4-oxopentyl)-1-cyclohexanone 3-(1-nitro-4-oxopentyl)cyclohexan-1-one 3-(4-keto-1-nitro-pentyl)cyclohexanone
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Formula C11H17NO4
InChI InChI=1S/C11H17NO4/c1-8(13)5-6-11(12(15)16)9-3-2-4-10(14)7-9/h9,11H,2-7H2,1H3
InChIKey KRNSDFFTNCOATI-UHFFFAOYSA-N
Molecular Weight 227.260 g/mol
SMILES C(N(=O)=O)(C1CC(=O)CCC1)CCC(=O)C
SPLASH splash10-006x-9400000000-fdfddec0b9c0b82ed946
Source of Spectrum AH-126-1018-4
Wiley ID 1228527