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(2Z)-2-(3-keto-1,4-dihydroquinoxalin-2-ylidene)acetic acid methyl ester
SpectraBase Compound ID Kywi8BwVH6l
InChI InChI=1S/C11H10N2O3/c1-16-10(14)6-9-11(15)13-8-5-3-2-4-7(8)12-9/h2-6,12H,1H3,(H,13,15)/b9-6-
InChIKey JHBSHCXBAZNMSM-TWGQIWQCSA-N
Mol Weight 218.21 g/mol
Molecular Formula C11H10N2O3
Exact Mass 218.069142 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LydDQTXsGMn
Name (2Z)-2-(3-Keto-1,4-dihydroquinoxalin-2-ylidene)acetic acid methyl ester
Comments Computed using HOSE algorithm
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Exact Mass 218.069142187 u
Formula C11H10N2O3
InChI InChI=1S/C11H10N2O3/c1-16-10(14)6-9-11(15)13-8-5-3-2-4-7(8)12-9/h2-6,12H,1H3,(H,13,15)/b9-6-
InChIKey JHBSHCXBAZNMSM-TWGQIWQCSA-N
Molecular Weight 218.212 g/mol
SMILES C1(\C(NC=2C(N1)=CC=CC2)=C\C(=O)OC)=O