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3-(Acetyloxy)-5-ethoxy-2-nitrocyclohexyl acetate
SpectraBase Compound ID 6wqQ2pyQjRP
InChI InChI=1S/C12H19NO7/c1-4-18-9-5-10(19-7(2)14)12(13(16)17)11(6-9)20-8(3)15/h9-12H,4-6H2,1-3H3
InChIKey LVPRTFIEPIWEEW-UHFFFAOYSA-N
Mol Weight 289.28 g/mol
Molecular Formula C12H19NO7
Exact Mass 289.116152 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5uOaHUMfJKb
Name 3-(Acetyloxy)-5-ethoxy-2-nitrocyclohexyl acetate
Alternate Name(s) (3-acetoxy-5-ethoxy-2-nitro-cyclohexyl) acetate (3-acetyloxy-5-ethoxy-2-nitro-cyclohexyl) ethanoate Acetic acid (3-acetoxy-5-ethoxy-2-nitro-cyclohexyl) ester Acetic acid (3-acetyloxy-5-ethoxy-2-nitrocyclohexyl) ester Cyclohexane, 5-ethoxy-1,3-dihydroxy-2-nitro-, diacetate
CAS Registry Number 114454-74-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H19NO7
InChI InChI=1S/C12H19NO7/c1-4-18-9-5-10(19-7(2)14)12(13(16)17)11(6-9)20-8(3)15/h9-12H,4-6H2,1-3H3
InChIKey LVPRTFIEPIWEEW-UHFFFAOYSA-N
Molecular Weight 289.284 g/mol
SMILES C1(C(C(CC(C1)OCC)OC(C)=O)N(=O)=O)OC(C)=O
SPLASH splash10-002f-9200000000-0fd430ad4a2897faa1d2
Wiley ID 1478335