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Trans-2-methoxycinnamic acid, tetradecyl ester

View entire compound with spectra: 1 NMR, and 1 FTIR

Trans-2-methoxycinnamic acid, tetradecyl ester
SpectraBase Compound ID KMlmFSObKma
InChI InChI=1S/C24H38O3/c1-3-4-5-6-7-8-9-10-11-12-13-16-21-27-24(25)20-19-22-17-14-15-18-23(22)26-2/h14-15,17-20H,3-13,16,21H2,1-2H3/b20-19+
InChIKey OBKUQRMQDKXMNH-FMQUCBEESA-N
Mol Weight 374.6 g/mol
Molecular Formula C24H38O3
Exact Mass 374.282095 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Dh9sQt3ffxY
Name Trans-2-methoxycinnamic acid, tetradecyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 374.282095081 u
Formula C24H38O3
InChI InChI=1S/C24H38O3/c1-3-4-5-6-7-8-9-10-11-12-13-16-21-27-24(25)20-19-22-17-14-15-18-23(22)26-2/h14-15,17-20H,3-13,16,21H2,1-2H3/b20-19+
InChIKey OBKUQRMQDKXMNH-FMQUCBEESA-N
Molecular Weight 374.565 g/mol
SMILES C(OCCCCCCCCCCCCCC)(=O)\C=C\C1=C(OC)C=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.909859