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Dibenzo[g,o][1,6,9,14,2,5,10,13]tetrathiatetraazacyclohexadecine, 7,8,17,18-tetraphenyl-
SpectraBase Compound ID Jn7IfTwOvOs
InChI InChI=1S/C40H28N4S4/c1-5-17-29(18-6-1)37-38(30-19-7-2-8-20-30)42-46-35-27-15-16-28-36(35)48-44-40(32-23-11-4-12-24-32)39(31-21-9-3-10-22-31)43-47-34-26-14-13-25-33(34)45-41-37/h1-28H/b41-37-,42-38-,43-39-,44-40-
InChIKey LHWXPPRLBDXNEJ-SDLHUVDUSA-N
Mol Weight 692.9 g/mol
Molecular Formula C40H28N4S4
Exact Mass 692.119682 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DSftMuCogIc
Name Dibenzo[g,o][1,6,9,14,2,5,10,13]tetrathiatetraazacyclohexadecine, 7,8,17,18-tetraphenyl-
Alternate Name(s) 6,7,14,15-Tetraphenyl-dibenzo[ac]cyclohexadeca-5,7,13,15-tetraene, 1,4,9,12-tetathia-5,8,13,16-tetraaza 7,8,17,18-tetraphenyldibenzo[g,o][1,6,9,14,2,5,10,13]tetrathiatetraazacyclohexadecine
CAS Registry Number 124614-54-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C40H28N4S4
InChI InChI=1S/C40H28N4S4/c1-5-17-29(18-6-1)37-38(30-19-7-2-8-20-30)42-46-35-27-15-16-28-36(35)48-44-40(32-23-11-4-12-24-32)39(31-21-9-3-10-22-31)43-47-34-26-14-13-25-33(34)45-41-37/h1-28H/b41-37-,42-38-,43-39-,44-40-
InChIKey LHWXPPRLBDXNEJ-SDLHUVDUSA-N
Molecular Weight 692.932 g/mol
SMILES c12S\N=C/(\C(=N/Sc3c(S\N=C/(\C(=N/Sc2cccc1)c1ccccc1)c1ccccc1)cccc3)c1ccccc1)c1ccccc1
SPLASH splash10-0006-0922001000-ab15cf3900c3a4e6625a
Source of Spectrum I-67-1785-5
Wiley ID 1414791