| SpectraBase Compound ID | VeAVJraQme |
|---|---|
| InChI | InChI=1S/C9H12O2/c1-11-9(10)7-6-8-4-2-3-5-8/h4,6-7H,2-3,5H2,1H3/b7-6+ |
| InChIKey | QTKPJQLBCMHWQI-VOTSOKGWSA-N |
| Mol Weight | 152.19 g/mol |
| Molecular Formula | C9H12O2 |
| Exact Mass | 152.08373 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 9rvFXjxTa87 |
|---|---|
| Name | (E)-3-(1-Cyclopentenyl)-2-propenoic acid methyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 152.083729624 u |
| Formula | C9H12O2 |
| InChI | InChI=1S/C9H12O2/c1-11-9(10)7-6-8-4-2-3-5-8/h4,6-7H,2-3,5H2,1H3/b7-6+ |
| InChIKey | QTKPJQLBCMHWQI-VOTSOKGWSA-N |
| Molecular Weight | 152.193 g/mol |
| SMILES | C1(\C=C\C(=O)OC)=CCCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.985645 |