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3,6,8-triethyl-2-formyl-1,4,5,7-tetramethylporphyrin
SpectraBase Compound ID 9t77jJS083q
InChI InChI=1S/C31H34N4O/c1-8-20-16(4)24-11-25-17(5)22(10-3)30(33-25)14-31-23(15-36)19(7)27(35-31)13-29-21(9-2)18(6)26(34-29)12-28(20)32-24/h11-15,32,35H,8-10H2,1-7H3/b24-11-,25-11-,26-12-,27-13-,28-12-,29-13-,30-14-,31-14-
InChIKey FCOVVWKRRGDHFZ-AKEKELSESA-N
Mol Weight 478.6 g/mol
Molecular Formula C31H34N4O
Exact Mass 478.273262 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DYH4m6UuMAu
Name 3,6,8-triethyl-2-formyl-1,4,5,7-tetramethylporphyrin
CAS Registry Number 96246-95-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H34N4O
InChI InChI=1S/C31H34N4O/c1-8-20-16(4)24-11-25-17(5)22(10-3)30(33-25)14-31-23(15-36)19(7)27(35-31)13-29-21(9-2)18(6)26(34-29)12-28(20)32-24/h11-15,32,35H,8-10H2,1-7H3/b24-11-,25-11-,26-12-,27-13-,28-12-,29-13-,30-14-,31-14-
InChIKey FCOVVWKRRGDHFZ-AKEKELSESA-N
Molecular Weight 478.640 g/mol
SMILES [nH]1c2c(c(c1cc1nc(cc3[nH]c(cc4nc(c2)c(c4C)CC)c(c3CC)C)c(c1CC)C)C)C=O
SPLASH splash10-004i-0001900000-ee1cb69da95ac28d88ae
Source of Spectrum J-50-2079-12
Synonyms 9,14,20-triethyl-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-4-carbaldehyde
Wiley ID 1394883