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[6-(Phenylthiomethyl)-3-carbazolyl] - [6'-(3''-carbazolylmethyl)-3'-carbazolyl]methylium - Tetrafluoroborate
SpectraBase Compound ID EwspjhXmhVI
InChI InChI=1S/C45H32N3S.BF4/c1-2-6-33(7-3-1)49-27-32-14-19-45-39(26-32)38-25-31(13-18-44(38)48-45)21-30-12-17-43-37(24-30)36-23-29(11-16-42(36)47-43)20-28-10-15-41-35(22-28)34-8-4-5-9-40(34)46-41;2-1(3,4)5/h1-19,21-26,46-48H,20,27H2;/q+1;-1
InChIKey FYNNSYLOFVEYEX-UHFFFAOYSA-N
Mol Weight 733.6 g/mol
Molecular Formula C45H32BF4N3S
Exact Mass 733.234612 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1SumkvObdWl
Name [6-(Phenylthiomethyl)-3-carbazolyl] - [6'-(3''-carbazolylmethyl)-3'-carbazolyl]methylium - Tetrafluoroborate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C45H32BF4N3S
InChI InChI=1S/C45H32N3S.BF4/c1-2-6-33(7-3-1)49-27-32-14-19-45-39(26-32)38-25-31(13-18-44(38)48-45)21-30-12-17-43-37(24-30)36-23-29(11-16-42(36)47-43)20-28-10-15-41-35(22-28)34-8-4-5-9-40(34)46-41;2-1(3,4)5/h1-19,21-26,46-48H,20,27H2;/q+1;-1
InChIKey FYNNSYLOFVEYEX-UHFFFAOYSA-N
Molecular Weight 733.636 g/mol
SMILES [B-](F)(F)(F)F.[nH]1c2c(cc([CH+]c3ccc4[nH]c5c(c4c3)cc(cc5)CSc3ccccc3)cc2)c2c1ccc(Cc1cc3c4c(cccc4)[nH]c3cc1)c2
SPLASH splash10-03di-0900000000-d28521c5dd7fbe4c6cca
Source of Spectrum F3-27-116-8
Synonyms [6-(9H-carbazol-3-ylmethyl)-9H-carbazol-3-yl]({6-[(phenylsulfanyl)methyl]-9H-carbazol-3-yl})methylium; tetrafluoroboranuide
Wiley ID 1565443