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3-Benzylidene-2,5-dimethyl-4-ethoxycarbonl-2,3-dihydrofuran

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

3-Benzylidene-2,5-dimethyl-4-ethoxycarbonl-2,3-dihydrofuran
SpectraBase Compound ID 75H77qyTBCz
InChI InChI=1S/C16H18O3/c1-4-18-16(17)15-12(3)19-11(2)14(15)10-13-8-6-5-7-9-13/h5-11H,4H2,1-3H3/b14-10+
InChIKey IDIVPLRJQPJRLL-GXDHUFHOSA-N
Mol Weight 258.32 g/mol
Molecular Formula C16H18O3
Exact Mass 258.125594 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID AWifUXvek32
Name 3-Benzylidene-2,5-dimethyl-4-ethoxycarbonl-2,3-dihydrofuran
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 258.125594437 u
Formula C16H18O3
InChI InChI=1S/C16H18O3/c1-4-18-16(17)15-12(3)19-11(2)14(15)10-13-8-6-5-7-9-13/h5-11H,4H2,1-3H3/b14-10+
InChIKey IDIVPLRJQPJRLL-GXDHUFHOSA-N
Molecular Weight 258.317 g/mol
SMILES C=1(\C(C(C)OC1C)=C\C1=CC=CC=C1)C(=O)OCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.915503