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2,5-Dihydro-2,2-dimethyl-5-oxo-4-styrylfuran-3-carboxylic acid

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2,5-Dihydro-2,2-dimethyl-5-oxo-4-styrylfuran-3-carboxylic acid
SpectraBase Compound ID 1WzxosfOIJt
InChI InChI=1S/C15H14O4/c1-15(2)12(13(16)17)11(14(18)19-15)9-8-10-6-4-3-5-7-10/h3-9H,1-2H3,(H,16,17)/b9-8+
InChIKey RNWWTNGLWFNDOR-CMDGGOBGSA-N
Mol Weight 258.27 g/mol
Molecular Formula C15H14O4
Exact Mass 258.089209 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HshulEvpIrw
Name 2,5-Dihydro-2,2-dimethyl-5-oxo-4-styrylfuran-3-carboxylic acid
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 258.089208927 u
Formula C15H14O4
InChI InChI=1S/C15H14O4/c1-15(2)12(13(16)17)11(14(18)19-15)9-8-10-6-4-3-5-7-10/h3-9H,1-2H3,(H,16,17)/b9-8+
InChIKey RNWWTNGLWFNDOR-CMDGGOBGSA-N
Molecular Weight 258.273 g/mol
SMILES C1(C(=C(\C=C\C2=CC=CC=C2)C(O1)=O)C(=O)O)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.924724