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2-Methoxybenzoic acid, 4-isopropylphenyl ester
SpectraBase Compound ID 6np1sQuxS0w
InChI InChI=1S/C17H18O3/c1-12(2)13-8-10-14(11-9-13)20-17(18)15-6-4-5-7-16(15)19-3/h4-12H,1-3H3
InChIKey SZUAYFDDKTZDHG-UHFFFAOYSA-N
Mol Weight 270.33 g/mol
Molecular Formula C17H18O3
Exact Mass 270.125594 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2KyS5aRTLWm
Name 2-Methoxybenzoic acid, 4-isopropylphenyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 270.125594437 u
Formula C17H18O3
InChI InChI=1S/C17H18O3/c1-12(2)13-8-10-14(11-9-13)20-17(18)15-6-4-5-7-16(15)19-3/h4-12H,1-3H3
InChIKey SZUAYFDDKTZDHG-UHFFFAOYSA-N
SMILES CC(C)C1=CC=C(OC(C2=C(C=CC=C2)OC)=O)C=C1