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13,17-Diethyl-2,8,12,18-tetramethyl-3,5-(2,2-dimethylpropano)porphyrin

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13,17-Diethyl-2,8,12,18-tetramethyl-3,5-(2,2-dimethylpropano)porphyrin
SpectraBase Compound ID 2o6ESXsFJfS
InChI InChI=1S/C33H38N4/c1-9-21-18(4)26-12-25-17(3)11-29(34-25)24-16-33(7,8)15-23-20(6)28(37-32(23)24)13-27-19(5)22(10-2)31(36-27)14-30(21)35-26/h11-14,34,36H,9-10,15-16H2,1-8H3/b25-12+,26-12+,27-13+,28-13+,29-24-,30-14+,31-14+
InChIKey CGRZNLMEHYAVRR-CJLSDTLSSA-N
Mol Weight 490.7 g/mol
Molecular Formula C33H38N4
Exact Mass 490.309647 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JnTf2QnDQBj
Name 13,17-Diethyl-2,8,12,18-tetramethyl-3,5-(2,2-dimethylpropano)porphyrin
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 490.309647240 u
Formula C33H38N4
InChI InChI=1S/C33H38N4/c1-9-21-18(4)26-12-25-17(3)11-29(34-25)24-16-33(7,8)15-23-20(6)28(37-32(23)24)13-27-19(5)22(10-2)31(36-27)14-30(21)35-26/h11-14,34,36H,9-10,15-16H2,1-8H3/b25-12+,26-12+,27-13+,28-13+,29-24-,30-14+,31-14+
InChIKey CGRZNLMEHYAVRR-CJLSDTLSSA-N
Molecular Weight 490.695 g/mol
SMILES C12=NC3=CC=4NC(C=C5N=C(C=C6NC(=C2CC(CC1=C3C)(C)C)C=C6C)C(=C5CC)C)=C(C4C)CC