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2H-1-Benzopyran-2-one, 8-methoxy-3-(3-phenyl-1,2,4-oxadiazol-5-yl)-

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2H-1-Benzopyran-2-one, 8-methoxy-3-(3-phenyl-1,2,4-oxadiazol-5-yl)-
SpectraBase Compound ID 428nOhCTx7u
InChI InChI=1S/C18H12N2O4/c1-22-14-9-5-8-12-10-13(18(21)23-15(12)14)17-19-16(20-24-17)11-6-3-2-4-7-11/h2-10H,1H3
InChIKey AAHQMAREQZQLTO-UHFFFAOYSA-N
Mol Weight 320.3 g/mol
Molecular Formula C18H12N2O4
Exact Mass 320.079707 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H7mulpcD2IX
Name 2H-1-Benzopyran-2-one, 8-methoxy-3-(3-phenyl-1,2,4-oxadiazol-5-yl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 320.079706870 u
Formula C18H12N2O4
InChI InChI=1S/C18H12N2O4/c1-22-14-9-5-8-12-10-13(18(21)23-15(12)14)17-19-16(20-24-17)11-6-3-2-4-7-11/h2-10H,1H3
InChIKey AAHQMAREQZQLTO-UHFFFAOYSA-N
Molecular Weight 320.304 g/mol
SMILES C=1(C2=NC(C3=CC=CC=C3)=NO2)C(OC=2C(C1)=CC=CC2OC)=O