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3,10-Dithiatetracyclo[10.6.2.2(5,8).0(16,20)]docosan-5,7,21,12,14,16(20),17,1(19)-octaene
SpectraBase Compound ID 7RVpHSK9KgR
InChI InChI=1S/C20H18S2/c1-2-18-9-8-17-10-20(18)19(3-1)14-22-12-16-6-4-15(5-7-16)11-21-13-17/h1-10H,11-14H2
InChIKey JHSOCDGQFBKBJF-UHFFFAOYSA-N
Mol Weight 322.48 g/mol
Molecular Formula C20H18S2
Exact Mass 322.084993 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ENKQwjvgMXC
Name 3,10-Dithiatetracyclo[10.6.2.2(5,8).0(16,20)]docosan-5,7,21,12,14,16(20),17,1(19)-octaene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H18S2
InChI InChI=1S/C20H18S2/c1-2-18-9-8-17-10-20(18)19(3-1)14-22-12-16-6-4-15(5-7-16)11-21-13-17/h1-10H,11-14H2
InChIKey JHSOCDGQFBKBJF-UHFFFAOYSA-N
Molecular Weight 322.484 g/mol
SMILES c12cc3CSCc4ccc(CSCc2cccc1cc3)cc4
SPLASH splash10-00di-0906000000-41c3b86fe1c130b3b9ec
Source of Spectrum O-26-654-12
Synonyms 3,10-dithiatetracyclo[10.6.2.2(5,8).0(15,19)]docosa-1(19),5,7,12,14,15,17,19,21-nonaene
Wiley ID 1321937