| SpectraBase Compound ID | YwWCfcUrLd |
|---|---|
| InChI | InChI=1S/C14H18/c1-10(2)6-7-14-12(4)8-11(3)9-13(14)5/h7-9H,1-5H3 |
| InChIKey | HJWGJDPRFKOZQO-UHFFFAOYSA-N |
| Mol Weight | 186.3 g/mol |
| Molecular Formula | C14H18 |
| Exact Mass | 186.140851 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 1GCg3x0ny9l |
|---|---|
| Name | 3',3'-Dimethyl-2-allenylmesitylene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 186.140850580 u |
| Formula | C14H18 |
| InChI | InChI=1S/C14H18/c1-10(2)6-7-14-12(4)8-11(3)9-13(14)5/h7-9H,1-5H3 |
| InChIKey | HJWGJDPRFKOZQO-UHFFFAOYSA-N |
| Molecular Weight | 186.298 g/mol |
| SMILES | C1=C(C(=C(C=C1C)C)C=C=C(C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.937204 |