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(4b.alpha.,8b.beta.,12b.alpha.,16b.beta.)-4b,12b;8b,16b-Bis(1,4-dithiabutano)-4b,8b,12b,16b-tetrahydrodibenzo[a,f]dibenzo[2,3:4,5]pentaleno[1,6-cd]pentalene

View entire compound with spectra: 1 MS (GC)

(4b.alpha.,8b.beta.,12b.alpha.,16b.beta.)-4b,12b;8b,16b-Bis(1,4-dithiabutano)-4b,8b,12b,16b-tetrahydrodibenzo[a,f]dibenzo[2,3:4,5]pentaleno[1,6-cd]pentalene
SpectraBase Compound ID F4KxL14iqXi
InChI InChI=1S/C33H24S4/c1-2-10-22-21(9-1)29-23-11-3-4-12-24(23)31-27-15-7-8-16-28(27)32(36-18-17-34-29)26-14-6-5-13-25(26)30(22,33(29,31)32)35-19-20-37-31/h1-16H,17-20H2/t29-,30+,31-,32+,33-
InChIKey XXRAUDHJFXOSGQ-PBAVWIDCSA-N
Mol Weight 548.8 g/mol
Molecular Formula C33H24S4
Exact Mass 548.076085 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5prQeDzT72q
Name (4b.alpha.,8b.beta.,12b.alpha.,16b.beta.)-4b,12b;8b,16b-Bis(1,4-dithiabutano)-4b,8b,12b,16b-tetrahydrodibenzo[a,f]dibenzo[2,3:4,5]pentaleno[1,6-cd]pentalene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H24S4
InChI InChI=1S/C33H24S4/c1-2-10-22-21(9-1)29-23-11-3-4-12-24(23)31-27-15-7-8-16-28(27)32(36-18-17-34-29)26-14-6-5-13-25(26)30(22,33(29,31)32)35-19-20-37-31/h1-16H,17-20H2/t29-,30+,31-,32+,33-
InChIKey XXRAUDHJFXOSGQ-PBAVWIDCSA-N
Molecular Weight 548.795 g/mol
SMILES C123[C@]45c6ccccc6[C@]33c6ccccc6[C@@]1(c1ccccc1[C@@]2(c1ccccc51)SCCS3)SCCS4
SPLASH splash10-0a4i-0103900000-970aa1b1c906b9f61b80
Source of Spectrum F-54-5256-20
Wiley ID 806871