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Bis(2-methylpropyl) 3-methylbenzene-1,2-dicarboxylate

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

Bis(2-methylpropyl) 3-methylbenzene-1,2-dicarboxylate
SpectraBase Compound ID HYn6caucZVa
InChI InChI=1S/C17H24O4/c1-11(2)9-20-16(18)14-8-6-7-13(5)15(14)17(19)21-10-12(3)4/h6-8,11-12H,9-10H2,1-5H3
InChIKey CVLHWRUCBCTAMX-UHFFFAOYSA-N
Mol Weight 292.38 g/mol
Molecular Formula C17H24O4
Exact Mass 292.167459 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID H4mBwDpdQR8
Name bis(2-Methylpropyl) 3-methylbenzene-1,2-dicarboxylate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 292.167459249 u
Formula C17H24O4
InChI InChI=1S/C17H24O4/c1-11(2)9-20-16(18)14-8-6-7-13(5)15(14)17(19)21-10-12(3)4/h6-8,11-12H,9-10H2,1-5H3
InChIKey CVLHWRUCBCTAMX-UHFFFAOYSA-N
SMILES C1(=C(C(=CC=C1)C(OCC(C)C)=O)C(OCC(C)C)=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.875006