![6-Spiro[2.4]heptanecarboxylic acid](/api/spectrum/DWpsRwRdugv/structure.png?h=300&w=458 "6-Spiro[2.4]heptanecarboxylic acid")
| SpectraBase Compound ID | z7O7MbCIRO |
|---|---|
| InChI | InChI=1S/C8H12O2/c9-7(10)6-1-2-8(5-6)3-4-8/h6H,1-5H2,(H,9,10) |
| InChIKey | IIPOHIIXHDZIAO-UHFFFAOYSA-N |
| Mol Weight | 140.18 g/mol |
| Molecular Formula | C8H12O2 |
| Exact Mass | 140.08373 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | DWpsRwRdugv |
|---|---|
| Name | 6-Spiro[2.4]heptanecarboxylic acid |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 140.083729624 u |
| Formula | C8H12O2 |
| InChI | InChI=1S/C8H12O2/c9-7(10)6-1-2-8(5-6)3-4-8/h6H,1-5H2,(H,9,10) |
| InChIKey | IIPOHIIXHDZIAO-UHFFFAOYSA-N |
| SMILES | C12(CC2)CC(C(=O)O)CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.959346 |