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4-Hydroxy-3-methoxyphenylacetic acid, ethyl ester, pfp

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4-Hydroxy-3-methoxyphenylacetic acid, ethyl ester, pfp
SpectraBase Compound ID 8zHT4mxIaeY
InChI InChI=1S/C14H13F5O5/c1-3-23-11(20)7-8-4-5-9(10(6-8)22-2)24-12(21)13(15,16)14(17,18)19/h4-6H,3,7H2,1-2H3
InChIKey FOHGYZQJJYYONC-UHFFFAOYSA-N
Mol Weight 356.25 g/mol
Molecular Formula C14H13F5O5
Exact Mass 356.068314 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 91rOkeSPMl7
Name 4-Hydroxy-3-methoxyphenylacetic acid, ethyl ester, pfp
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 356.068314329 u
Formula C14H13F5O5
InChI InChI=1S/C14H13F5O5/c1-3-23-11(20)7-8-4-5-9(10(6-8)22-2)24-12(21)13(15,16)14(17,18)19/h4-6H,3,7H2,1-2H3
InChIKey FOHGYZQJJYYONC-UHFFFAOYSA-N
Molecular Weight 356.245 g/mol
SMILES C1=C(C=CC(=C1OC)OC(=O)C(F)(F)C(F)(F)F)CC(OCC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.974926