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1-(6-Methoxynaphthalen-2-yl)butane-1,3-dione
SpectraBase Compound ID EZ8Lbg8yjJE
InChI InChI=1S/C15H14O3/c1-10(16)7-15(17)13-4-3-12-9-14(18-2)6-5-11(12)8-13/h3-6,8-9H,7H2,1-2H3
InChIKey HGXDFGVHMYOSDC-UHFFFAOYSA-N
Mol Weight 242.27 g/mol
Molecular Formula C15H14O3
Exact Mass 242.094294 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4SWCOBIdEEh
Name 1-(6-Methoxynaphthalen-2-yl)butane-1,3-dione
Comments Computed using HOSE algorithm
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Exact Mass 242.094294308 u
Formula C15H14O3
InChI InChI=1S/C15H14O3/c1-10(16)7-15(17)13-4-3-12-9-14(18-2)6-5-11(12)8-13/h3-6,8-9H,7H2,1-2H3
InChIKey HGXDFGVHMYOSDC-UHFFFAOYSA-N
Molecular Weight 242.274 g/mol
SMILES C(CC(C)=O)(=O)C1=CC2=C(C=C1)C=C(C=C2)OC