| SpectraBase Compound ID | 4dlL2xyLZKp |
|---|---|
| InChI | InChI=1S/C30H54/c1-3-5-7-9-11-13-15-17-19-21-23-29-25-27-30(28-26-29)24-22-20-18-16-14-12-10-8-6-4-2/h25-28H,3-24H2,1-2H3 |
| InChIKey | UDDNERKMSGPLJQ-UHFFFAOYSA-N |
| Mol Weight | 414.8 g/mol |
| Molecular Formula | C30H54 |
| Exact Mass | 414.422552 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CXd7oBSNwn |
|---|---|
| Name | 1,4-di-N-Dodecylbenzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 414.422551739 u |
| Formula | C30H54 |
| InChI | InChI=1S/C30H54/c1-3-5-7-9-11-13-15-17-19-21-23-29-25-27-30(28-26-29)24-22-20-18-16-14-12-10-8-6-4-2/h25-28H,3-24H2,1-2H3 |
| InChIKey | UDDNERKMSGPLJQ-UHFFFAOYSA-N |
| Molecular Weight | 414.762 g/mol |
| SMILES | C=1(C=CC(=CC1)CCCCCCCCCCCC)CCCCCCCCCCCC |