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Benzoic acid, 3,5-dimethoxy-, 3-methoxy-5-methylphenyl ester

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Benzoic acid, 3,5-dimethoxy-, 3-methoxy-5-methylphenyl ester
SpectraBase Compound ID 2R9J1GWIgx9
InChI InChI=1S/C17H18O5/c1-11-5-13(19-2)10-16(6-11)22-17(18)12-7-14(20-3)9-15(8-12)21-4/h5-10H,1-4H3
InChIKey UGGVITWPKFHTSG-UHFFFAOYSA-N
Mol Weight 302.33 g/mol
Molecular Formula C17H18O5
Exact Mass 302.115424 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3xD3EFKHkls
Name Benzoic acid, 3,5-dimethoxy-, 3-methoxy-5-methylphenyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 302.115423675 u
Formula C17H18O5
InChI InChI=1S/C17H18O5/c1-11-5-13(19-2)10-16(6-11)22-17(18)12-7-14(20-3)9-15(8-12)21-4/h5-10H,1-4H3
InChIKey UGGVITWPKFHTSG-UHFFFAOYSA-N
SMILES C1(=CC(=CC(=C1)OC)OC)C(OC1=CC(=CC(=C1)C)OC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.928853