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10-Isopropyl-5,15-diphenylporphyrin

View entire compound with spectra: 1 NMR, and 1 MS (GC)

10-Isopropyl-5,15-diphenylporphyrin
SpectraBase Compound ID 3g8nNdECbYs
InChI InChI=1S/C35H28N4/c1-22(2)33-27-17-19-31(38-27)34(23-9-5-3-6-10-23)29-15-13-25(36-29)21-26-14-16-30(37-26)35(24-11-7-4-8-12-24)32-20-18-28(33)39-32/h3-22,36,39H,1-2H3/b25-21-,26-21-,33-27-,33-28-,34-29-,34-31-,35-30-,35-32-
InChIKey XGWTZQWSLDQXLW-YCXAHOTOSA-N
Mol Weight 504.6 g/mol
Molecular Formula C35H28N4
Exact Mass 504.231397 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EaDhwIp6mmV
Name 10-Isopropyl-5,15-diphenylporphyrin
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 504.231396918 u
Formula C35H28N4
InChI InChI=1S/C35H28N4/c1-22(2)33-27-17-19-31(38-27)34(23-9-5-3-6-10-23)29-15-13-25(36-29)21-26-14-16-30(37-26)35(24-11-7-4-8-12-24)32-20-18-28(33)39-32/h3-22,36,39H,1-2H3/b25-21-,26-21-,33-27-,33-28-,34-29-,34-31-,35-30-,35-32-
InChIKey XGWTZQWSLDQXLW-YCXAHOTOSA-N
Molecular Weight 504.637 g/mol
SMILES C=12N=C(C(=C3NC(=C(C4=CC=CC=C4)C4=NC(=CC=5NC(C1C=1C=CC=CC1)=CC5)C=C4)C=C3)C(C)C)C=C2