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(2-Isopropyl-5,10,15,20-tetraphenylporphyrinato)copper
SpectraBase Compound ID 21zGQUnpDEt
InChI InChI=1S/C47H34N4.Cu/c1-30(2)35-29-42-45(33-19-11-5-12-20-33)40-26-25-38(49-40)43(31-15-7-3-8-16-31)36-23-24-37(48-36)44(32-17-9-4-10-18-32)39-27-28-41(50-39)46(47(35)51-42)34-21-13-6-14-22-34;/h3-30H,1-2H3;/q-2;+2/b43-36-,43-38-,44-37-,44-39-,45-40-,45-42-,46-41-,47-46-;
InChIKey XIBQNTNXISQSIX-GBGVRRJWSA-N
Mol Weight 718.4 g/mol
Molecular Formula C47H34CuN4
Exact Mass 717.207944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JTk5Pa5nEB2
Name (2-Isopropyl-5,10,15,20-tetraphenylporphyrinato)copper
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C47H34CuN4
InChI InChI=1S/C47H34N4.Cu/c1-30(2)35-29-42-45(33-19-11-5-12-20-33)40-26-25-38(49-40)43(31-15-7-3-8-16-31)36-23-24-37(48-36)44(32-17-9-4-10-18-32)39-27-28-41(50-39)46(47(35)51-42)34-21-13-6-14-22-34;/h3-30H,1-2H3;/q-2;+2/b43-36-,43-38-,44-37-,44-39-,45-40-,45-42-,46-41-,47-46-;
InChIKey XIBQNTNXISQSIX-GBGVRRJWSA-N
Molecular Weight 718.363 g/mol
SMILES C1=2[N]=3[Cu]45N6C(=C(C3C=C1)c1ccccc1)C=CC6=C(c1ccccc1)C1=[N]4C(C=C1)=C(c1[n]5c(C2c2ccccc2)c(C(C)C)c1)c1ccccc1
SPLASH splash10-014i-0000003900-2c8a0665233637d47018
Source of Spectrum J-59-4436-8
Synonyms 7,12,17,24-tetraphenyl-9-(propan-2-yl)-2,22,23,25-tetraaza-1-cupraoctacyclo[11.9.1.1(1,8).1(3,21).0(2,6).0(16,23).0(18,22).0(11,25)]pentacosa-2,4,6,8,10,12,14,16(23),17,19,21(24)-undecaene
Wiley ID 1415560