| SpectraBase Compound ID | FJPE4H6iHVh |
|---|---|
| InChI | InChI=1S/C8H13ClO3/c9-4-3-8(10)12-6-7-2-1-5-11-7/h7H,1-6H2 |
| InChIKey | GOKMPKJTXRTDFE-UHFFFAOYSA-N |
| Mol Weight | 192.64 g/mol |
| Molecular Formula | C8H13ClO3 |
| Exact Mass | 192.055322 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 | DgBFIBuVh3I |
|---|---|
| Name | 3-Chloropropionic acid, 2-tetrahydrofurylmethyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 192.055321976 u |
| Formula | C8H13ClO3 |
| InChI | InChI=1S/C8H13ClO3/c9-4-3-8(10)12-6-7-2-1-5-11-7/h7H,1-6H2 |
| InChIKey | GOKMPKJTXRTDFE-UHFFFAOYSA-N |
| Molecular Weight | 192.642 g/mol |
| SMILES | C1OC(CC1)COC(CCCl)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.91539 |