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3-(Acetyloxy)-5-methyl-2-nitrocyclohexyl acetate
SpectraBase Compound ID BhORY1GTAXI
InChI InChI=1S/C11H17NO6/c1-6-4-9(17-7(2)13)11(12(15)16)10(5-6)18-8(3)14/h6,9-11H,4-5H2,1-3H3
InChIKey YGINXUAYCXMVCL-UHFFFAOYSA-N
Mol Weight 259.26 g/mol
Molecular Formula C11H17NO6
Exact Mass 259.105587 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3oWkOYszLFA
Name 3-(Acetyloxy)-5-methyl-2-nitrocyclohexyl acetate
CAS Registry Number 114454-71-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H17NO6
InChI InChI=1S/C11H17NO6/c1-6-4-9(17-7(2)13)11(12(15)16)10(5-6)18-8(3)14/h6,9-11H,4-5H2,1-3H3
InChIKey YGINXUAYCXMVCL-UHFFFAOYSA-N
Molecular Weight 259.258 g/mol
SMILES C1(N(=O)=O)C(CC(CC1OC(=O)C)C)OC(=O)C
SPLASH splash10-01ox-9600000000-f7ece9c6b5236365ec5d
Source of Spectrum H-71-10-8
Synonyms (3-acetoxy-5-methyl-2-nitro-cyclohexyl) acetate (3-acetyloxy-5-methyl-2-nitro-cyclohexyl) ethanoate Acetic acid (3-acetoxy-5-methyl-2-nitro-cyclohexyl) ester Acetic acid (3-acetyloxy-5-methyl-2-nitrocyclohexyl) ester
Wiley ID 1262517