| SpectraBase Spectrum ID |
83WTDMSSMhO |
| Name |
Glutaric acid, monochloride, 3-methylbut-3-enyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
218.070972040 u |
| Formula |
C10H15ClO3 |
| InChI |
InChI=1S/C10H15ClO3/c1-8(2)6-7-14-10(13)5-3-4-9(11)12/h1,3-7H2,2H3 |
| InChIKey |
PLXBVXVPKNVJIS-UHFFFAOYSA-N |
| Molecular Weight |
218.680 g/mol |
| SMILES |
CC(CCOC(CCCC(Cl)=O)=O)=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.972519 |
