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2-Benzofuranyl ketone
SpectraBase Compound ID 2rtuRsLf3aA
InChI InChI=1S/C17H10O3/c18-17(15-9-11-5-1-3-7-13(11)19-15)16-10-12-6-2-4-8-14(12)20-16/h1-10H
InChIKey ZLYFWIZGRHGKMM-UHFFFAOYSA-N
Mol Weight 262.26 g/mol
Molecular Formula C17H10O3
Exact Mass 262.062994 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Li7dzEeBymZ
Name 2-Benzofuranyl ketone
Comments Computed using HOSE algorithm
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Exact Mass 262.062994179 u
Formula C17H10O3
InChI InChI=1S/C17H10O3/c18-17(15-9-11-5-1-3-7-13(11)19-15)16-10-12-6-2-4-8-14(12)20-16/h1-10H
InChIKey ZLYFWIZGRHGKMM-UHFFFAOYSA-N
Molecular Weight 262.264 g/mol
SMILES C(=O)(C=1OC2=C(C1)C=CC=C2)C=1OC2=C(C1)C=CC=C2