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(2-methyl-3-nitro-cyclohexen-1-yl) acetate
SpectraBase Compound ID eFERWhZC8a
InChI InChI=1S/C9H13NO4/c1-6-8(10(12)13)4-3-5-9(6)14-7(2)11/h8H,3-5H2,1-2H3
InChIKey KEVWSSNTZRGITB-UHFFFAOYSA-N
Mol Weight 199.21 g/mol
Molecular Formula C9H13NO4
Exact Mass 199.084458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GYKzP0TDhCi
Name (2-methyl-3-nitro-cyclohexen-1-yl) acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13NO4
InChI InChI=1S/C9H13NO4/c1-6-8(10(12)13)4-3-5-9(6)14-7(2)11/h8H,3-5H2,1-2H3
InChIKey KEVWSSNTZRGITB-UHFFFAOYSA-N
Molecular Weight 199.206 g/mol
SMILES C1(=C(OC(=O)C)CCCC1N(=O)=O)C
SPLASH splash10-03dl-7900000000-b794e3b72ebe85fb4561
Source of Spectrum F-51-1804-7
Synonyms (2-methyl-3-nitro-cyclohexen-1-yl) ethanoate Acetic acid (2-methyl-3-nitro-1-cyclohexenyl) ester Acetic acid (2-methyl-3-nitro-cyclohexen-1-yl) ester
Wiley ID 790892