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7-(2,6-Dioxocyclohexyl)bicyclo[2.2.1]heptan-2-nitrate
SpectraBase Compound ID GBd5M0dnzvl
InChI InChI=1S/C13H17NO5/c15-9-2-1-3-10(16)13(9)12-7-4-5-8(12)11(6-7)19-14(17)18/h7-8,11-13H,1-6H2/t7?,8?,11-,12?/m0/s1
InChIKey KJUZFMIJMZVKPI-FLXSCQPWSA-N
Mol Weight 267.28 g/mol
Molecular Formula C13H17NO5
Exact Mass 267.110673 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5AFvnJBgns5
Name 7-(2,6-Dioxocyclohexyl)bicyclo[2.2.1]heptan-2-nitrate
Alternate Name(s) (S)-7-(2,6-Dioxocyclohexyl)bicyclo[2.2.1]heptan-2-nitrate 7-(2,6-dioxocyclohexyl)bicyclo[2.2.1]hept-2-yl nitrate
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Formula C13H17NO5
InChI InChI=1S/C13H17NO5/c15-9-2-1-3-10(16)13(9)12-7-4-5-8(12)11(6-7)19-14(17)18/h7-8,11-13H,1-6H2/t7?,8?,11-,12?/m0/s1
InChIKey KJUZFMIJMZVKPI-FLXSCQPWSA-N
Molecular Weight 267.281 g/mol
SMILES [C@]1(ON(=O)=O)(C2C(C3C(=O)CCCC3=O)C(C1)CC2)[H]
SPLASH splash10-0w70-0940000000-2305317a9815c226d770
Source of Spectrum KC-0-2942-11
Wiley ID 831572