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Benzoic acid, 2-hydroxy-3,5,6-trimethyl-4-(phenylmethoxy)-, methyl ester

View entire compound with spectra: 1 NMR, and 2 MS (GC)

Benzoic acid, 2-hydroxy-3,5,6-trimethyl-4-(phenylmethoxy)-, methyl ester
SpectraBase Compound ID GCn1zghOjwK
InChI InChI=1S/C18H20O4/c1-11-12(2)17(22-10-14-8-6-5-7-9-14)13(3)16(19)15(11)18(20)21-4/h5-9,19H,10H2,1-4H3
InChIKey FZAKPFZCEORQLU-UHFFFAOYSA-N
Mol Weight 300.35 g/mol
Molecular Formula C18H20O4
Exact Mass 300.136159 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8cVafan3zI0
Name Benzoic acid, 2-hydroxy-3,5,6-trimethyl-4-(phenylmethoxy)-, methyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 300.136159120 u
Formula C18H20O4
InChI InChI=1S/C18H20O4/c1-11-12(2)17(22-10-14-8-6-5-7-9-14)13(3)16(19)15(11)18(20)21-4/h5-9,19H,10H2,1-4H3
InChIKey FZAKPFZCEORQLU-UHFFFAOYSA-N
Molecular Weight 300.354 g/mol
SMILES C1(=C(C(=C(C(=C1C)OCC=1C=CC=CC1)C)C)C(=O)OC)O