| SpectraBase Compound ID | CgTLGF3x8kD |
|---|---|
| InChI | InChI=1S/C14H18/c1-4-11-9-14(10(2)3)13-8-6-5-7-12(11)13/h5-10,14H,4H2,1-3H3 |
| InChIKey | IXYXDNSLNZZOOZ-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 | DILeUcRpWs8 |
|---|---|
| Name | 1H-Indene, 3-ethyl-1-(1-methylethyl)- |
| 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/c1-4-11-9-14(10(2)3)13-8-6-5-7-12(11)13/h5-10,14H,4H2,1-3H3 |
| InChIKey | IXYXDNSLNZZOOZ-UHFFFAOYSA-N |
| Molecular Weight | 186.298 g/mol |
| SMILES | C1=CC=C2C(=C1)C(C(C)C)C=C2CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.842909 |