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2-Isopropyl-5,10,15,20-tetraphenylporphyrin
SpectraBase Compound ID JKG7sdtyNdk
InChI InChI=1S/C47H36N4/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/h3-30,48,51H,1-2H3/b43-36-,43-38-,44-37-,44-39-,45-40-,45-42-,46-41-,47-46-
InChIKey NHKMDHSMBIUCSH-LQTONPHTSA-N
Mol Weight 656.8 g/mol
Molecular Formula C47H36N4
Exact Mass 656.293997 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DL5OJWgVQAe
Name 2-Isopropyl-5,10,15,20-tetraphenylporphyrin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C47H36N4
InChI InChI=1S/C47H36N4/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/h3-30,48,51H,1-2H3/b43-36-,43-38-,44-37-,44-39-,45-40-,45-42-,46-41-,47-46-
InChIKey NHKMDHSMBIUCSH-LQTONPHTSA-N
Molecular Weight 656.833 g/mol
SMILES [nH]1c2c(cc1c(c1nc(c(c3[nH]c(c(c4nc(c2-c2ccccc2)cc4)-c2ccccc2)cc3)-c2ccccc2)cc1)-c1ccccc1)C(C)C
SPLASH splash10-0a4i-0000009000-bc43b9a687e090921a35
Source of Spectrum J-59-4436-16
Synonyms 4-isopropyl-2,7,12,17-tetraphenyl-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
Wiley ID 1413397