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3,4-Dihydroxybenzophenone, bis(2-methylpropionate)

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

3,4-Dihydroxybenzophenone, bis(2-methylpropionate)
SpectraBase Compound ID 8a3pNdiLEI2
InChI InChI=1S/C21H22O5/c1-13(2)20(23)25-17-11-10-16(12-18(17)26-21(24)14(3)4)19(22)15-8-6-5-7-9-15/h5-14H,1-4H3
InChIKey CDHGTDMSRCOKCU-UHFFFAOYSA-N
Mol Weight 354.4 g/mol
Molecular Formula C21H22O5
Exact Mass 354.146724 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6sNYbeOGOYg
Name 3,4-Dihydroxybenzophenone, bis(2-methylpropionate)
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 354.146723803 u
Formula C21H22O5
InChI InChI=1S/C21H22O5/c1-13(2)20(23)25-17-11-10-16(12-18(17)26-21(24)14(3)4)19(22)15-8-6-5-7-9-15/h5-14H,1-4H3
InChIKey CDHGTDMSRCOKCU-UHFFFAOYSA-N
Molecular Weight 354.402 g/mol
SMILES C1(OC(C(C)C)=O)=C(C=CC(=C1)C(=O)C1=CC=CC=C1)OC(C(C)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.951788