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2-(5,6,11,12-Tetrahydrodibenzo[a,e]cyclooctene-2-yl)-1,3-dithiane
SpectraBase Compound ID 7VIG9ot7t4H
InChI InChI=1S/C20H22S2/c1-2-5-16-8-10-18-14-19(20-21-12-3-13-22-20)11-9-17(18)7-6-15(16)4-1/h1-2,4-5,9,11,14,20H,3,6-8,10,12-13H2
InChIKey PAQIETIYIIJINW-UHFFFAOYSA-N
Mol Weight 326.52 g/mol
Molecular Formula C20H22S2
Exact Mass 326.116293 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LGGdYxWDxAA
Name 2-(5,6,11,12-Tetrahydrodibenzo[a,e]cyclooctene-2-yl)-1,3-dithiane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22S2
InChI InChI=1S/C20H22S2/c1-2-5-16-8-10-18-14-19(20-21-12-3-13-22-20)11-9-17(18)7-6-15(16)4-1/h1-2,4-5,9,11,14,20H,3,6-8,10,12-13H2
InChIKey PAQIETIYIIJINW-UHFFFAOYSA-N
Molecular Weight 326.516 g/mol
SMILES C1(SCCCS1)c1cc2c(CCc3c(CC2)cccc3)cc1
SPLASH splash10-0fb9-1379000000-0713989e10864f417ca3
Source of Spectrum Y1-45-2970-5
Synonyms 2-(5,6,11,12-tetrahydrodibenzo[a,e]cycloocten-2-yl)-1,3-dithiane
Wiley ID 1621920