| SpectraBase Compound ID | 5HAgYVaRWWp |
|---|---|
| InChI | InChI=1S/C26H46/c1-5-9-13-17-23-21-25(19-15-11-7-3)26(20-16-12-8-4)22-24(23)18-14-10-6-2/h21-22H,5-20H2,1-4H3 |
| InChIKey | HLQIGUBKMVCBBZ-UHFFFAOYSA-N |
| Mol Weight | 358.7 g/mol |
| Molecular Formula | C26H46 |
| Exact Mass | 358.359951 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 6DpTrb2gBg0 |
|---|---|
| Name | 1,2,4,5-Tetrapentylbenzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 358.359951481 u |
| Formula | C26H46 |
| InChI | InChI=1S/C26H46/c1-5-9-13-17-23-21-25(19-15-11-7-3)26(20-16-12-8-4)22-24(23)18-14-10-6-2/h21-22H,5-20H2,1-4H3 |
| InChIKey | HLQIGUBKMVCBBZ-UHFFFAOYSA-N |
| Molecular Weight | 358.654 g/mol |
| SMILES | C=1C(=C(C=C(C1CCCCC)CCCCC)CCCCC)CCCCC |