| SpectraBase Compound ID | 8IaC2uXzzMz |
|---|---|
| InChI | InChI=1S/C21H44/c1-7-19(4)13-8-9-14-20(5)16-11-17-21(6)15-10-12-18(2)3/h18-21H,7-17H2,1-6H3 |
| InChIKey | ZZEQNXPBKOFTBG-UHFFFAOYSA-N |
| Mol Weight | 296.6 g/mol |
| Molecular Formula | C21H44 |
| Exact Mass | 296.344301 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 4viYmWQWVRU |
|---|---|
| Name | Heptadecane, 2,6,10,15-tetramethyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 296.344301417 u |
| Formula | C21H44 |
| InChI | InChI=1S/C21H44/c1-7-19(4)13-8-9-14-20(5)16-11-17-21(6)15-10-12-18(2)3/h18-21H,7-17H2,1-6H3 |
| InChIKey | ZZEQNXPBKOFTBG-UHFFFAOYSA-N |
| SMILES | C(CCC(CCCCC(CC)C)C)C(CCCC(C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.909778 |