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3-Chloro-N-(9,10-dioxo-9,10-dihydroantracen-1-yl)-propionamide

View entire compound with spectra: 1 NMR, and 1 FTIR

3-Chloro-N-(9,10-dioxo-9,10-dihydroantracen-1-yl)-propionamide
SpectraBase Compound ID K2O7ocB32Wc
InChI InChI=1S/C17H12ClNO3/c18-9-8-14(20)19-13-7-3-6-12-15(13)17(22)11-5-2-1-4-10(11)16(12)21/h1-7H,8-9H2,(H,19,20)
InChIKey OHMZLNNTHYTFNW-UHFFFAOYSA-N
Mol Weight 313.74 g/mol
Molecular Formula C17H12ClNO3
Exact Mass 313.050571 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5efw140RrVs
Name 3-Chloro-N-(9,10-dioxo-9,10-dihydroantracen-1-yl)-propionamide
Comments Computed using HOSE algorithm
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Exact Mass 313.050570947 u
Formula C17H12ClNO3
InChI InChI=1S/C17H12ClNO3/c18-9-8-14(20)19-13-7-3-6-12-15(13)17(22)11-5-2-1-4-10(11)16(12)21/h1-7H,8-9H2,(H,19,20)
InChIKey OHMZLNNTHYTFNW-UHFFFAOYSA-N
Molecular Weight 313.740 g/mol
SMILES C1=2C(C3=C(C(C2C=CC=C1NC(CCCl)=O)=O)C=CC=C3)=O