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2-Hydroxybenzoic acid 6-salicyloyloxyhexyl ester
SpectraBase Compound ID G9NeZrJDdOo
InChI InChI=1S/C20H22O6/c21-17-11-5-3-9-15(17)19(23)25-13-7-1-2-8-14-26-20(24)16-10-4-6-12-18(16)22/h3-6,9-12,21-22H,1-2,7-8,13-14H2
InChIKey BOPXLSMVXSTANB-UHFFFAOYSA-N
Mol Weight 358.39 g/mol
Molecular Formula C20H22O6
Exact Mass 358.141638 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9lKDDDEtI62
Name 2-Hydroxybenzoic acid 6-salicyloyloxyhexyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 358.141638422 u
Formula C20H22O6
InChI InChI=1S/C20H22O6/c21-17-11-5-3-9-15(17)19(23)25-13-7-1-2-8-14-26-20(24)16-10-4-6-12-18(16)22/h3-6,9-12,21-22H,1-2,7-8,13-14H2
InChIKey BOPXLSMVXSTANB-UHFFFAOYSA-N
Molecular Weight 358.390 g/mol
SMILES C=1(C(=O)OCCCCCCOC(C=2C(O)=CC=CC2)=O)C(O)=CC=CC1