| SpectraBase Compound ID | Hty2R3mLrZN |
|---|---|
| InChI | InChI=1S/C5H9ClO/c1-4-5(2,3-6)7-4/h4H,3H2,1-2H3 |
| InChIKey | NQMMSWOUZOSQDH-UHFFFAOYSA-N |
| Mol Weight | 120.58 g/mol |
| Molecular Formula | C5H9ClO |
| Exact Mass | 120.034193 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | ClGHNr7pxE6 |
|---|---|
| Name | 2-(Chloromethyl)-2,3-dimethyl-oxirane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 120.034192609 u |
| Formula | C5H9ClO |
| InChI | InChI=1S/C5H9ClO/c1-4-5(2,3-6)7-4/h4H,3H2,1-2H3 |
| InChIKey | NQMMSWOUZOSQDH-UHFFFAOYSA-N |
| SMILES | C1(OC1C)(CCl)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.879244 |