| SpectraBase Compound ID | FUuQhCMNUXH |
|---|---|
| InChI | InChI=1S/C6H9BrO2/c1-6(7)3-4(6)5(8)9-2/h4H,3H2,1-2H3 |
| InChIKey | KYIUXHGCRSARRN-UHFFFAOYSA-N |
| Mol Weight | 193.04 g/mol |
| Molecular Formula | C6H9BrO2 |
| Exact Mass | 191.978593 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 | GAEymBMMcck |
|---|---|
| Name | Cyclopropanecarboxylic acid, 2-bromo-2-methyl-, methyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 191.978592528 u |
| Formula | C6H9BrO2 |
| InChI | InChI=1S/C6H9BrO2/c1-6(7)3-4(6)5(8)9-2/h4H,3H2,1-2H3 |
| InChIKey | KYIUXHGCRSARRN-UHFFFAOYSA-N |
| Molecular Weight | 193.040 g/mol |
| SMILES | C1C(C)(Br)C1C(OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.968 |