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2-(3-Benzyloxycarbonylphenyl)acetic acid

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

2-(3-Benzyloxycarbonylphenyl)acetic acid
SpectraBase Compound ID KJ42moUHJO5
InChI InChI=1S/C16H14O4/c17-15(18)10-13-7-4-8-14(9-13)16(19)20-11-12-5-2-1-3-6-12/h1-9H,10-11H2,(H,17,18)
InChIKey VKDRZEQVJBERDJ-UHFFFAOYSA-N
Mol Weight 270.28 g/mol
Molecular Formula C16H14O4
Exact Mass 270.089209 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HbfrvzsJTlt
Name 2-(3-Benzyloxycarbonylphenyl)acetic acid
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 270.089208927 u
Formula C16H14O4
InChI InChI=1S/C16H14O4/c17-15(18)10-13-7-4-8-14(9-13)16(19)20-11-12-5-2-1-3-6-12/h1-9H,10-11H2,(H,17,18)
InChIKey VKDRZEQVJBERDJ-UHFFFAOYSA-N
SMILES C(C1=CC(CC(=O)O)=CC=C1)(OCC=1C=CC=CC1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.835469