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2-Methyl-5-nitro-1(2H)-isoquinolinone
SpectraBase Compound ID Assr6MpsW6R
InChI InChI=1S/C10H8N2O3/c1-11-6-5-7-8(10(11)13)3-2-4-9(7)12(14)15/h2-6H,1H3
InChIKey ZJFKSSNHLIRRHQ-UHFFFAOYSA-N
Mol Weight 204.18 g/mol
Molecular Formula C10H8N2O3
Exact Mass 204.053492 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4yXWr0L7QcS
Name 2-Methyl-5-nitro-1(2H)-isoquinolinone
Alternate Name(s) 2-methyl-5-nitro-1-isoquinolinone 2-methyl-5-nitro-isocarbostyril 2-methyl-5-nitro-isoquinolin-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C10H8N2O3
InChI InChI=1S/C10H8N2O3/c1-11-6-5-7-8(10(11)13)3-2-4-9(7)12(14)15/h2-6H,1H3
InChIKey ZJFKSSNHLIRRHQ-UHFFFAOYSA-N
Molecular Weight 204.185 g/mol
SMILES C1(N(C=Cc2c(cccc12)N(=O)=O)C)=O
SPLASH splash10-0udi-0190000000-55704c2afc2478ff36fc
Source of Spectrum D8-323-152-12
Wiley ID 1513614