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Methyl 2'-methoxy-4-methyl-1',6-biphenyl-1-carboxylate

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

Methyl 2'-methoxy-4-methyl-1',6-biphenyl-1-carboxylate
SpectraBase Compound ID 6TsGYexbael
InChI InChI=1S/C16H16O3/c1-11-8-9-13(16(17)19-3)14(10-11)12-6-4-5-7-15(12)18-2/h4-10H,1-3H3
InChIKey BPVNPHIDYKIFGH-UHFFFAOYSA-N
Mol Weight 256.3 g/mol
Molecular Formula C16H16O3
Exact Mass 256.109944 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CJUpwpjIzK2
Name Methyl 2'-methoxy-4-methyl-1',6-biphenyl-1-carboxylate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 256.109944372 u
Formula C16H16O3
InChI InChI=1S/C16H16O3/c1-11-8-9-13(16(17)19-3)14(10-11)12-6-4-5-7-15(12)18-2/h4-10H,1-3H3
InChIKey BPVNPHIDYKIFGH-UHFFFAOYSA-N
Molecular Weight 256.301 g/mol
SMILES C=1C=C(C=2C=C(C=CC2C(=O)OC)C)C(=CC1)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.853424