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(E)-methyl 3-phenyl-2-(o-tolyl)acrylate

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

(E)-methyl 3-phenyl-2-(o-tolyl)acrylate
SpectraBase Compound ID okybHsqdUe
InChI InChI=1S/C17H16O2/c1-13-8-6-7-11-15(13)16(17(18)19-2)12-14-9-4-3-5-10-14/h3-12H,1-2H3/b16-12+
InChIKey XFVLOHKGYZPHLG-FOWTUZBSSA-N
Mol Weight 252.31 g/mol
Molecular Formula C17H16O2
Exact Mass 252.11503 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Ex5OrXAMglx
Name (E)-Methyl 3-phenyl-2-o-tolylacrylate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 252.115029753 u
Formula C17H16O2
InChI InChI=1S/C17H16O2/c1-13-8-6-7-11-15(13)16(17(18)19-2)12-14-9-4-3-5-10-14/h3-12H,1-2H3/b16-12+
InChIKey XFVLOHKGYZPHLG-FOWTUZBSSA-N
Molecular Weight 252.313 g/mol
SMILES C(\C(=C\C=1C=CC=CC1)C=1C(=CC=CC1)C)(=O)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.874675