| SpectraBase Compound ID | 5N2dZW2TRX3 |
|---|---|
| InChI | InChI=1S/C13H20/c1-10-6-7-11-12(2,3)8-5-9-13(10,11)4/h6-7H,5,8-9H2,1-4H3 |
| InChIKey | MREJDFVGHBTPDN-UHFFFAOYSA-N |
| Mol Weight | 176.3 g/mol |
| Molecular Formula | C13H20 |
| Exact Mass | 176.156501 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 7ExETW0a9v4 |
|---|---|
| Name | 3,3A,7,7-Tetramethyl-5,6-dihydro-4H-indene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 176.156500644 u |
| Formula | C13H20 |
| InChI | InChI=1S/C13H20/c1-10-6-7-11-12(2,3)8-5-9-13(10,11)4/h6-7H,5,8-9H2,1-4H3 |
| InChIKey | MREJDFVGHBTPDN-UHFFFAOYSA-N |
| Molecular Weight | 176.303 g/mol |
| SMILES | C1=2C(C(C)=CC2)(CCCC1(C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.959587 |