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2-Methylbenzoic acid, 2-biphenyl ester
SpectraBase Compound ID 1HYSvkGeERu
InChI InChI=1S/C20H16O2/c1-15-9-5-6-12-17(15)20(21)22-19-14-8-7-13-18(19)16-10-3-2-4-11-16/h2-14H,1H3
InChIKey FFIDUJGFQZZRER-UHFFFAOYSA-N
Mol Weight 288.35 g/mol
Molecular Formula C20H16O2
Exact Mass 288.11503 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F7VwndtrTkk
Name 2-Methylbenzoic acid, 2-biphenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 288.115029753 u
Formula C20H16O2
InChI InChI=1S/C20H16O2/c1-15-9-5-6-12-17(15)20(21)22-19-14-8-7-13-18(19)16-10-3-2-4-11-16/h2-14H,1H3
InChIKey FFIDUJGFQZZRER-UHFFFAOYSA-N
SMILES C(C1=C(C=CC=C1)C)(OC1=C(C2=CC=CC=C2)C=CC=C1)=O