![1-Oxaspiro[5.7]tridec-3-en-2-one](/api/spectrum/BIRLkdObZ9A/structure.png?h=300&w=458 "1-Oxaspiro[5.7]tridec-3-en-2-one")
| SpectraBase Compound ID | LYJDOIjz2V |
|---|---|
| InChI | InChI=1S/C12H18O2/c13-11-7-6-10-12(14-11)8-4-2-1-3-5-9-12/h6-7H,1-5,8-10H2 |
| InChIKey | GWSDDOJBPCIUJZ-UHFFFAOYSA-N |
| Mol Weight | 194.27 g/mol |
| Molecular Formula | C12H18O2 |
| Exact Mass | 194.13068 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 | BIRLkdObZ9A |
|---|---|
| Name | 1-Oxaspiro[5.7]tridec-3-en-2-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 194.130679818 u |
| Formula | C12H18O2 |
| InChI | InChI=1S/C12H18O2/c13-11-7-6-10-12(14-11)8-4-2-1-3-5-9-12/h6-7H,1-5,8-10H2 |
| InChIKey | GWSDDOJBPCIUJZ-UHFFFAOYSA-N |
| Molecular Weight | 194.274 g/mol |
| SMILES | C1(OC2(CC=C1)CCCCCCC2)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.807231 |