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Propanedioic acid, (2-methyl-2,3-butadienyl)-, dimethyl ester

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

Propanedioic acid, (2-methyl-2,3-butadienyl)-, dimethyl ester
SpectraBase Compound ID BUbT2e3y2kC
InChI InChI=1S/C10H14O4/c1-5-7(2)6-8(9(11)13-3)10(12)14-4/h8H,1,6H2,2-4H3
InChIKey VMYLMHFJPAUCEP-UHFFFAOYSA-N
Mol Weight 198.22 g/mol
Molecular Formula C10H14O4
Exact Mass 198.089209 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HVL5bbts5uy
Name Propanedioic acid, (2-methyl-2,3-butadienyl)-, dimethyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 198.089208927 u
Formula C10H14O4
InChI InChI=1S/C10H14O4/c1-5-7(2)6-8(9(11)13-3)10(12)14-4/h8H,1,6H2,2-4H3
InChIKey VMYLMHFJPAUCEP-UHFFFAOYSA-N
Molecular Weight 198.218 g/mol
SMILES C(C(=O)OC)(C(=O)OC)CC(=C=C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.946969