SpectraBase Spectrum ID |
qHhUZ1Lytt |
Name |
Hydracrylic acid, 2,2-dimethyl-, bimol. ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
218.115423675 u |
Formula |
C10H18O5 |
InChI |
InChI=1S/C10H18O5/c1-9(2,5-11)8(14)15-6-10(3,4)7(12)13/h11H,5-6H2,1-4H3,(H,12,13) |
InChIKey |
TUDDQPGTJUONEM-UHFFFAOYSA-N |
Molecular Weight |
218.249 g/mol |
SMILES |
OCC(C(OCC(C(O)=O)(C)C)=O)(C)C |
Spectrum/Structure Validation Score (Raman) |
0.979789 |