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2-[p-Nitrophenylacetylamino]-3-chloro-1,4-naphthoquinone

View entire compound with spectra: 1 NMR

2-[p-Nitrophenylacetylamino]-3-chloro-1,4-naphthoquinone
SpectraBase Compound ID HcQJsEMehVe
InChI InChI=1S/C18H11ClN2O5/c19-15-16(18(24)13-4-2-1-3-12(13)17(15)23)20-14(22)9-10-5-7-11(8-6-10)21(25)26/h1-8H,9H2,(H,20,22)
InChIKey DYRXQEFGOAIJBA-UHFFFAOYSA-N
Mol Weight 370.75 g/mol
Molecular Formula C18H11ClN2O5
Exact Mass 370.035649 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7cRGZoCit3b
Name 2-[p-Nitrophenylacetylamino]-3-chloro-1,4-naphthoquinone
Comments Computed using HOSE algorithm
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Exact Mass 370.035649157 u
Formula C18H11ClN2O5
InChI InChI=1S/C18H11ClN2O5/c19-15-16(18(24)13-4-2-1-3-12(13)17(15)23)20-14(22)9-10-5-7-11(8-6-10)21(25)26/h1-8H,9H2,(H,20,22)
InChIKey DYRXQEFGOAIJBA-UHFFFAOYSA-N
Molecular Weight 370.748 g/mol
SMILES C1(=CC=C(C=C1)N(=O)=O)CC(NC=1C(C2=C(C(C1Cl)=O)C=CC=C2)=O)=O