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3-Acetyl-1-methyl-5-nitropyrid-2-one
SpectraBase Compound ID 3wpj4quIa1g
InChI InChI=1S/C8H8N2O4/c1-5(11)7-3-6(10(13)14)4-9(2)8(7)12/h3-4H,1-2H3
InChIKey ZJLHLCYTACCJBF-UHFFFAOYSA-N
Mol Weight 196.16 g/mol
Molecular Formula C8H8N2O4
Exact Mass 196.048407 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 70htbjxhmR3
Name 3-Acetyl-1-methyl-5-nitropyrid-2-one
Alternate Name(s) 3-acetyl-1-methyl-5-nitro-2(1H)-pyridinone 3-acetyl-1-methyl-5-nitro-2-pyridinone 3-acetyl-1-methyl-5-nitropyridin-2-one 3-acetyl-1-methyl-5-nitro-pyridin-2-one 3-ethanoyl-1-methyl-5-nitro-pyridin-2-one
Comments Less than 3 mono-isotopic peaks
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Formula C8H8N2O4
InChI InChI=1S/C8H8N2O4/c1-5(11)7-3-6(10(13)14)4-9(2)8(7)12/h3-4H,1-2H3
InChIKey ZJLHLCYTACCJBF-UHFFFAOYSA-N
Molecular Weight 196.162 g/mol
SMILES C=1(C(N(C)C=C(C1)N(=O)=O)=O)C(=O)C
SPLASH splash10-001j-0900000000-c3faa8ca60909a517492
Source of Spectrum F-51-8603-11
Wiley ID 792962