| SpectraBase Compound ID | cZmeTj8M7E |
|---|---|
| InChI | InChI=1S/C16H20/c1-11(2)14-10-15(16(3,4)5)13-9-7-6-8-12(13)14/h6-10H,1-5H3 |
| InChIKey | LHYYGSXCZWYJQP-UHFFFAOYSA-N |
| Mol Weight | 212.34 g/mol |
| Molecular Formula | C16H20 |
| Exact Mass | 212.156501 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 3j0eQ1L5M9q |
|---|---|
| Name | 3-Tert-butyl-1-(isopropylidene)indene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 212.156500644 u |
| Formula | C16H20 |
| InChI | InChI=1S/C16H20/c1-11(2)14-10-15(16(3,4)5)13-9-7-6-8-12(13)14/h6-10H,1-5H3 |
| InChIKey | LHYYGSXCZWYJQP-UHFFFAOYSA-N |
| Molecular Weight | 212.336 g/mol |
| SMILES | C1(C=2C=CC=CC2C(C(C)(C)C)=C1)=C(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.954498 |