SpectraBase Compound ID | 8psFrNNaf25 |
---|---|
InChI | InChI=1S/C7H10O4/c1-5(7(9)10-3)4-11-6(2)8/h1,4H2,2-3H3 |
InChIKey | IMOQCGSCOCUDGV-UHFFFAOYSA-N |
Mol Weight | 158.15 g/mol |
Molecular Formula | C7H10O4 |
Exact Mass | 158.057909 g/mol |
SpectraBase Spectrum ID | EKcopueSflJ |
---|---|
Name | Methyl 2-(hydroxymethyl)acrylate, acetate |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 158.057908798 u |
Formula | C7H10O4 |
InChI | InChI=1S/C7H10O4/c1-5(7(9)10-3)4-11-6(2)8/h1,4H2,2-3H3 |
InChIKey | IMOQCGSCOCUDGV-UHFFFAOYSA-N |
SMILES | COC(=O)C(=C)COC(C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.990353 |