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15N4-3,8,13,17-Tetraethyl-2,7,12,18-tetramethylporphyrin (15N4-etioporphyrin-III)
SpectraBase Compound ID AXq3K2QYDWu
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-/i33+1,34+1,35+1,36+1
InChIKey RKKIUOCKADNTCD-OMUAISJCSA-N
Mol Weight 482.7 g/mol
Molecular Formula C32H3815N4
Exact Mass 482.297787 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4fIKxZpjtrZ
Name 15N4-3,8,13,17-Tetraethyl-2,7,12,18-tetramethylporphyrin (15N4-etioporphyrin-III)
Comments Original formula: C32H38[15N]4
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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-/i33+1,34+1,35+1,36+1
InChIKey RKKIUOCKADNTCD-OMUAISJCSA-N
Molecular Weight 482.656 g/mol
SMILES [15nH]1c2c(c(c1cc1[15n]c(cc3[15nH]c(cc4[15n]c(c2)c(c4CC)C)c(c3CC)C)c(c1C)CC)C)CC
SPLASH splash10-001i-0010900000-2ac437f97c96d17a86cd
Source of Spectrum KC-61-11597-3
Wiley ID 1631546