| SpectraBase Compound ID | 8nSiIFMF11e |
|---|---|
| InChI | InChI=1S/C8H10O2/c9-8(10)6-7-4-2-1-3-5-7/h1-4,7H,5-6H2,(H,9,10) |
| InChIKey | YZDDXOCIOCPVMK-UHFFFAOYSA-N |
| Mol Weight | 138.17 g/mol |
| Molecular Formula | C8H10O2 |
| Exact Mass | 138.06808 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 75ar8gqAtze |
|---|---|
| Name | 2-(1-Cyclohexa-2,4-dienyl)acetic acid |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 138.068079560 u |
| Formula | C8H10O2 |
| InChI | InChI=1S/C8H10O2/c9-8(10)6-7-4-2-1-3-5-7/h1-4,7H,5-6H2,(H,9,10) |
| InChIKey | YZDDXOCIOCPVMK-UHFFFAOYSA-N |
| Molecular Weight | 138.166 g/mol |
| SMILES | C(=O)(CC1C=CC=CC1)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.919825 |