SpectraBase Compound ID | 1AwjCNehn0H |
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InChI | InChI=1S/C8H12O5/c1-4-13-6(8(10)12-3)5-7(9)11-2/h5H,4H2,1-3H3/b6-5+ |
InChIKey | ILRHLOMYOXFNKR-AATRIKPKSA-N |
Mol Weight | 188.18 g/mol |
Molecular Formula | C8H12O5 |
Exact Mass | 188.068473 g/mol |
SpectraBase Spectrum ID | ESoUmOWYAja |
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Name | Dimethyl ethoxymaleate |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 188.068473481 u |
Formula | C8H12O5 |
InChI | InChI=1S/C8H12O5/c1-4-13-6(8(10)12-3)5-7(9)11-2/h5H,4H2,1-3H3/b6-5+ |
InChIKey | ILRHLOMYOXFNKR-AATRIKPKSA-N |
Molecular Weight | 188.179 g/mol |
SMILES | C(\C(=C/C(=O)OC)OCC)(=O)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.941811 |