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Poly(dibenzyl itaconate)
SpectraBase Compound ID 1bgL65e72ml
InChI InChI=1S/C21H24O4/c1-3-21(2,20(23)25-16-18-12-8-5-9-13-18)14-19(22)24-15-17-10-6-4-7-11-17/h4-13H,3,14-16H2,1-2H3
InChIKey NZSILBAZCJEBLU-UHFFFAOYSA-N
Mol Weight 340.42 g/mol
Molecular Formula C21H24O4
Exact Mass 340.167459 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID AUZFrBhbRG7
Name Poly(dibenzyl itaconate)
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 340.167459249 u
Formula C21H24O4
InChI InChI=1S/C21H24O4/c1-3-21(2,20(23)25-16-18-12-8-5-9-13-18)14-19(22)24-15-17-10-6-4-7-11-17/h4-13H,3,14-16H2,1-2H3
InChIKey NZSILBAZCJEBLU-UHFFFAOYSA-N
Molecular Weight 340.419 g/mol
Nominal Mass 340 u
SMILES C(OC(C(C)(CC)CC(OCC1=CC=CC=C1)=O)=O)C=1C=CC=CC1
Spectrum/Structure Validation Score (Raman) 0.951201