Hexadecahydro-N,N',N",N"'-tetramethyl-tetrabenzo[26]porphyrinogen-(3,3,3,3)

SpectraBase Compound ID	9Tq6cXkO1Eo
InChI	InChI=1S/C48H60N4/c1-49-41-25-13-27-43-35-19-7-9-21-37(35)45(50(43)2)29-15-31-47-39-23-11-12-24-40(39)48(52(47)4)32-16-30-46-38-22-10-8-20-36(38)44(51(46)3)28-14-26-42(49)34-18-6-5-17-33(34)41/h13-16,25,28-29,32H,5-12,17-24,26-27,30-31H2,1-4H3/b25-13+,28-14+,29-15+,32-16+
InChIKey	YCJJPIXHKDCREL-VJXKNDMQSA-N Google Search
Mol Weight	693.0 g/mol
Molecular Formula	C48H60N4
Exact Mass	692.481798 g/mol

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SpectraBase Spectrum ID	46EKKqdmym
Name	Hexadecahydro-N,N',N",N"'-tetramethyl-tetrabenzo[26]porphyrinogen-(3,3,3,3)
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C48H60N4
InChI	InChI=1S/C48H60N4/c1-49-41-25-13-27-43-35-19-7-9-21-37(35)45(50(43)2)29-15-31-47-39-23-11-12-24-40(39)48(52(47)4)32-16-30-46-38-22-10-8-20-36(38)44(51(46)3)28-14-26-42(49)34-18-6-5-17-33(34)41/h13-16,25,28-29,32H,5-12,17-24,26-27,30-31H2,1-4H3/b25-13+,28-14+,29-15+,32-16+
InChIKey	YCJJPIXHKDCREL-VJXKNDMQSA-N
Molecular Weight	693.036 g/mol
SMILES	c12[n](c(c3CCCCc23)C\C=C\c2[n](c(C\C=C\c3c4CCCCc4c([n]3C)C\C=C\c3[n](c(C\C=C\1)c1c3CCCC1)C)c1c2CCCC1)C)C
SPLASH	splash10-05fu-4901003000-0eca8dc075d477ba2cc9
Source of Spectrum	U-1994-509-25
Synonyms	Hexadecahydro-N,N',N'',N'''-tetramethyl-tetrabenzo[26]porphyrinogen-(3,3,3,3)
Wiley ID	765787