SpectraBase Compound ID | 41NOFjYHYke |
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InChI | InChI=1S/C28H30N4/c1-5-6-7-22-23-12-8-18(29-23)16-20-10-14-25(31-20)27(28(2,3)4)26-15-11-21(32-26)17-19-9-13-24(22)30-19/h8-17,29,32H,5-7H2,1-4H3/b18-16-,19-17-,20-16-,21-17-,23-22-,24-22-,27-25+,27-26+ |
InChIKey | QAEMQAGYTNQTHX-GLXOKZGISA-N |
Mol Weight | 422.58 g/mol |
Molecular Formula | C28H30N4 |
Exact Mass | 422.247047 g/mol |
SpectraBase Spectrum ID | Ee1moSqhXe2 |
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Name | 5-(n-Butyl)-15-(tert-butyl)porphyrin |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C28H30N4 |
InChI | InChI=1S/C28H30N4/c1-5-6-7-22-23-12-8-18(29-23)16-20-10-14-25(31-20)27(28(2,3)4)26-15-11-21(32-26)17-19-9-13-24(22)30-19/h8-17,29,32H,5-7H2,1-4H3/b18-16-,19-17-,20-16-,21-17-,23-22-,24-22-,27-25+,27-26+ |
InChIKey | QAEMQAGYTNQTHX-GLXOKZGISA-N |
Molecular Weight | 422.576 g/mol |
SMILES | [nH]1c2ccc1cc1nc(c(c3ccc(cc4nc(c2CCCC)cc4)[nH]3)C(C)(C)C)cc1 |
SPLASH | splash10-05fr-0001900000-22b0a0acc1db9f098067 |
Source of Spectrum | U1-2010-248-38 |
Wiley ID | 1663756 |