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3,8,13,17-Tetraethyl-2,7,12,18-tetramethylporphyrin (etioporpyrin-III)
SpectraBase Compound ID JbWvY76pGVt
InChI InChI=1S/C32H38N4/c1-9-21-17(5)25-13-26-18(6)23(11-3)31(34-26)16-32-24(12-4)20(8)28(36-32)15-30-22(10-2)19(7)27(35-30)14-29(21)33-25/h13-16,33,36H,9-12H2,1-8H3/b25-13-,26-13-,27-14-,28-15-,29-14-,30-15-,31-16-,32-16-
InChIKey RKKIUOCKADNTCD-UJJXFSCMSA-N
Mol Weight 478.7 g/mol
Molecular Formula C32H38N4
Exact Mass 478.309647 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HfDIk0Dku7o
Name 3,8,13,17-Tetraethyl-2,7,12,18-tetramethylporphyrin (etioporpyrin-III)
Alternate Name(s) 21H,23H-Porphine, 2,7,12,18-tetraethyl-3,8,13,17-tetramethyl- Etioporphyrin III Porphine, 2,7,12,18-tetraethyl-3,8,13,17-tetramethyl- 2,7,12,18-Tetraethyl-3,8,13,17-tetramethylporphyrine 3,8,13,17-Tetraethyl-2,7,12,18-tetramethylporphyrin 4,9,14,20-tetraethyl-5,10,15,19-tetramethyl-21,22,23,24-tetraazapentacyclo[16.2.1.1(3,6).1(8,11).1(13,16)]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaene Etioporphyrin Etioporphyrin 3
CAS Registry Number 26608-34-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H38N4
InChI InChI=1S/C32H38N4/c1-9-21-17(5)25-13-26-18(6)23(11-3)31(34-26)16-32-24(12-4)20(8)28(36-32)15-30-22(10-2)19(7)27(35-30)14-29(21)33-25/h13-16,33,36H,9-12H2,1-8H3/b25-13-,26-13-,27-14-,28-15-,29-14-,30-15-,31-16-,32-16-
InChIKey RKKIUOCKADNTCD-UJJXFSCMSA-N
Molecular Weight 478.684 g/mol
SMILES [nH]1c2c(c(c1cc1nc(cc3[nH]c(cc4nc(c2)c(c4CC)C)c(c3CC)C)c(c1C)CC)C)CC
SPLASH splash10-004i-0010900000-30e028ffb6665ee05c3a
Source of Spectrum KC-61-11597-3
Wiley ID 1631547