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2-Nitro-3-oxidanyl-cyclohex-2-en-1-one
SpectraBase Compound ID BQ4ig9XcNIx
InChI InChI=1S/C6H7NO4/c8-4-2-1-3-5(9)6(4)7(10)11/h8H,1-3H2
InChIKey QSCHCHYLCCSLLY-UHFFFAOYSA-N
Mol Weight 157.12 g/mol
Molecular Formula C6H7NO4
Exact Mass 157.037508 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BOGpbJTXJnb
Name 2-Nitro-3-oxidanyl-cyclohex-2-en-1-one
Alternate Name(s) 3-Hydroxy-2-nitro-1-cyclohex-2-enone 3-Hydroxy-2-nitro-cyclohex-2-en-1-one
CAS Registry Number 70500-95-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H7NO4
InChI InChI=1S/C6H7NO4/c8-4-2-1-3-5(9)6(4)7(10)11/h8H,1-3H2
InChIKey QSCHCHYLCCSLLY-UHFFFAOYSA-N
Molecular Weight 157.125 g/mol
SMILES OC1=C(N(=O)=O)C(=O)CCC1
SPLASH splash10-0a4l-9700000000-eb8681680fcf1c918407
Source of Spectrum H-62-502-0
Wiley ID 1154516