| SpectraBase Compound ID | 8cVNRNvnZNr |
|---|---|
| InChI | InChI=1S/C12H21ClO/c13-11-9-7-5-3-1-2-4-6-8-10-12(11)14/h11H,1-10H2 |
| InChIKey | VDNDILHUSVTMNI-UHFFFAOYSA-N |
| Mol Weight | 216.75 g/mol |
| Molecular Formula | C12H21ClO |
| Exact Mass | 216.128093 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 | DVCgkMMZDjU |
|---|---|
| Name | Cyclododecanone, 2-chloro- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 216.128092995 u |
| Formula | C12H21ClO |
| InChI | InChI=1S/C12H21ClO/c13-11-9-7-5-3-1-2-4-6-8-10-12(11)14/h11H,1-10H2 |
| InChIKey | VDNDILHUSVTMNI-UHFFFAOYSA-N |
| Molecular Weight | 216.752 g/mol |
| SMILES | C1CCCCCC(C(CCCC1)Cl)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.87289 |