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9,10-Bis(benzo[d][1,3]-dithiol-2-ylidene)-1,8-[13-crown-5]-9,10-dihydroanthracene

View entire compound with spectra: 1 MS (GC)

9,10-Bis(benzo[d][1,3]-dithiol-2-ylidene)-1,8-[13-crown-5]-9,10-dihydroanthracene
SpectraBase Compound ID Fsc2TQUPG3v
InChI InChI=1S/C36H30O5S4/c1-2-12-28-27(11-1)42-35(43-28)31-23-7-5-9-25-32(23)34(36-44-29-13-3-4-14-30(29)45-36)33-24(31)8-6-10-26(33)41-22-20-39-18-16-37-15-17-38-19-21-40-25/h1-14H,15-22H2
InChIKey LGDBNTBBHILHEX-UHFFFAOYSA-N
Mol Weight 670.9 g/mol
Molecular Formula C36H30O5S4
Exact Mass 670.097609 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CkZe4NdWR3o
Name 9,10-Bis(benzo[d][1,3]-dithiol-2-ylidene)-1,8-[13-crown-5]-9,10-dihydroanthracene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H30O5S4
InChI InChI=1S/C36H30O5S4/c1-2-12-28-27(11-1)42-35(43-28)31-23-7-5-9-25-32(23)34(36-44-29-13-3-4-14-30(29)45-36)33-24(31)8-6-10-26(33)41-22-20-39-18-16-37-15-17-38-19-21-40-25/h1-14H,15-22H2
InChIKey LGDBNTBBHILHEX-UHFFFAOYSA-N
Molecular Weight 670.871 g/mol
SMILES C1(=C2Sc3ccccc3S2)c2c3cccc2OCCOCCOCCOCCOc2c1c(C3=C1Sc3ccccc3S1)ccc2
SPLASH splash10-0229-0106009000-5ec641bf56a751a95ec3
Source of Spectrum H1-67-675-2
Wiley ID 1593466