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2,5,12,15,22,25-Hexathiatetracyclo[24.4.1.16,11.116,21]tritriaconta-3,6,8,10,13,16,18,20,23,26,28,30-dodecaene
SpectraBase Compound ID FGRyUHzIJUK
InChI InChI=1S/C27H24S6/c1-2-8-23-19-22(7-1)28-13-14-30-24-9-3-4-11-26(20-24)32-17-18-33-27-12-6-5-10-25(21-27)31-16-15-29-23/h1-18H,19-21H2/b14-13-,16-15-,18-17-
InChIKey VPEAYCRVFVOLNV-CCDCTNCYSA-N
Mol Weight 540.8 g/mol
Molecular Formula C27H24S6
Exact Mass 540.020228 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J38swpHOtEf
Name 2,5,12,15,22,25-Hexathiatetracyclo[24.4.1.16,11.116,21]tritriaconta-3,6,8,10,13,16,18,20,23,26,28,30-dodecaene
CAS Registry Number 85616-74-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H24S6
InChI InChI=1S/C27H24S6/c1-2-8-23-19-22(7-1)28-13-14-30-24-9-3-4-11-26(20-24)32-17-18-33-27-12-6-5-10-25(21-27)31-16-15-29-23/h1-18H,19-21H2/b14-13-,16-15-,18-17-
InChIKey VPEAYCRVFVOLNV-CCDCTNCYSA-N
Molecular Weight 540.849 g/mol
SMILES C=12S\C=C/SC=3CC(S\C=C/SC=4CC(S\C=C/SC(C2)=CC=CC1)=CC=CC4)=CC=CC3
SPLASH splash10-000b-6900000000-9c571dc780c7bd536232
Source of Spectrum J-50-184-15
Synonyms 2,5,12,15,22,25-hexathiatetracyclo[24.4.1.1(6,11).1(16,21)]tritriaconta-1(30),3,6,8,10,13,16,18,20,23,26,28-dodecaene
Wiley ID 1404611