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2,5-pyrrolidinedione, 3-[(3,4-dihydroxyphenyl)methylene]-1-(1-naphthalenyl)-, (3E)-
SpectraBase Compound ID 62fJMjw1Ylm
InChI InChI=1S/C21H15NO4/c23-18-9-8-13(11-19(18)24)10-15-12-20(25)22(21(15)26)17-7-3-5-14-4-1-2-6-16(14)17/h1-11,23-24H,12H2/b15-10+
InChIKey IBGQYZULISJSTB-XNTDXEJSSA-N
Mol Weight 345.35 g/mol
Molecular Formula C21H15NO4
Exact Mass 345.100108 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CHdz48KfPNY
Name 2,5-Pyrrolidinedione, 3-[(3,4-dihydroxyphenyl)methylene]-1-(1-naphthalenyl)-, (3E)-
Comments Computed using HOSE algorithm
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Exact Mass 345.100107963 u
Formula C21H15NO4
InChI InChI=1S/C21H15NO4/c23-18-9-8-13(11-19(18)24)10-15-12-20(25)22(21(15)26)17-7-3-5-14-4-1-2-6-16(14)17/h1-11,23-24H,12H2/b15-10+
InChIKey IBGQYZULISJSTB-XNTDXEJSSA-N
Molecular Weight 345.354 g/mol
SMILES OC=1C=C(C=CC1O)\C=C\1C(N(C(C1)=O)C1=C2C(C=CC=C2)=CC=C1)=O