![5-[3,5-Bis(tert-butyl)phenyl]porphyrin](/api/spectrum/K8KSm0zQ25y/structure.png?h=300&w=458 "5-[3,5-Bis(tert-butyl)phenyl]porphyrin")
| SpectraBase Compound ID | Ar7uicsMRua |
|---|---|
| InChI | InChI=1S/C34H34N4/c1-33(2,3)22-15-21(16-23(17-22)34(4,5)6)32-30-13-11-28(37-30)19-26-9-7-24(35-26)18-25-8-10-27(36-25)20-29-12-14-31(32)38-29/h7-20,35,38H,1-6H3/b24-18-,25-18-,26-19-,27-20-,28-19-,29-20-,32-30-,32-31- |
| InChIKey | LOODLEVTSHWETQ-ZRNPNLTDSA-N |
| Mol Weight | 498.7 g/mol |
| Molecular Formula | C34H34N4 |
| Exact Mass | 498.278347 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | K8KSm0zQ25y |
|---|---|
| Name | 5-[3,5-bis(Tert-butyl)phenyl]porphyrin |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 498.278347111 u |
| Formula | C34H34N4 |
| InChI | InChI=1S/C34H34N4/c1-33(2,3)22-15-21(16-23(17-22)34(4,5)6)32-30-13-11-28(37-30)19-26-9-7-24(35-26)18-25-8-10-27(36-25)20-29-12-14-31(32)38-29/h7-20,35,38H,1-6H3/b24-18-,25-18-,26-19-,27-20-,28-19-,29-20-,32-30-,32-31- |
| InChIKey | LOODLEVTSHWETQ-ZRNPNLTDSA-N |
| Molecular Weight | 498.674 g/mol |
| SMILES | C12=C(C=3NC(C=C4N=C(C=C5NC(=CC(=N2)C=C1)C=C5)C=C4)=CC3)C=1C=C(C(C)(C)C)C=C(C1)C(C)(C)C |