| SpectraBase Compound ID | GwlfuHAuRVC |
|---|---|
| InChI | InChI=1S/C9H14/c1-9(2,3)8-6-4-5-7-8/h4-8H,1-3H3 |
| InChIKey | ZATNUISQHWOHHK-UHFFFAOYSA-N |
| Mol Weight | 122.21 g/mol |
| Molecular Formula | C9H14 |
| Exact Mass | 122.10955 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 | HIrdG4U3x2 |
|---|---|
| Name | 1,3-Cyclopentadiene, 5-(1,1-dimethylethyl)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 122.109550451 u |
| Formula | C9H14 |
| InChI | InChI=1S/C9H14/c1-9(2,3)8-6-4-5-7-8/h4-8H,1-3H3 |
| InChIKey | ZATNUISQHWOHHK-UHFFFAOYSA-N |
| Molecular Weight | 122.211 g/mol |
| SMILES | CC(C)(C)C1C=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.827402 |