| SpectraBase Compound ID | BvPJG2wotYN |
|---|---|
| InChI | InChI=1S/C8H12O6/c1-11-5-13-7(9)3-4-8(10)14-6-12-2/h3-4H,5-6H2,1-2H3/b4-3+ |
| InChIKey | PWAQNDSVTBZZTJ-ONEGZZNKSA-N |
| Mol Weight | 204.18 g/mol |
| Molecular Formula | C8H12O6 |
| Exact Mass | 204.063388 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | KBmLliTRpKc |
|---|---|
| Name | Fumaric acid, bis(methoxymethyl) ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 204.063388100 u |
| Formula | C8H12O6 |
| InChI | InChI=1S/C8H12O6/c1-11-5-13-7(9)3-4-8(10)14-6-12-2/h3-4H,5-6H2,1-2H3/b4-3+ |
| InChIKey | PWAQNDSVTBZZTJ-ONEGZZNKSA-N |
| Molecular Weight | 204.178 g/mol |
| SMILES | C(=O)(OCOC)\C=C\C(OCOC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.85789 |