SpectraBase Spectrum ID |
G8IWSIdFytq |
Name |
5,28:14,19-Diethano-7,4:12,15:18,21:26,1-tetramethenodibenzo[f,r][1,12]dithiacyclotetracosin, 2,3,8,10,11,16,17,22,23,25-decahydro- |
CAS Registry Number |
88811-76-1 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C38H36S2 |
InChI |
InChI=1S/C38H36S2/c1-2-28-14-24-10-12-40-22-26-19-33-7-5-31-17-25(18-32-6-8-34(20-26)38(33)37(31)32)21-39-11-9-23-13-27(1)35-29(15-23)3-4-30(16-24)36(28)35/h13-20H,1-12,21-22H2 |
InChIKey |
CKBZEUIFWVZOGX-UHFFFAOYSA-N |
Molecular Weight |
556.826 g/mol |
SMILES |
c12-c3c4cc5cc3CCc1cc(cc2CC4)CSCCc1cc2CCc3cc(cc4c3-c2c(c1)CC4)CCSC5 |
SPLASH |
splash10-001i-0090030000-122063bc49d003acc5af |
Source of Spectrum |
K-117-257-0 |
Synonyms |
7,8,12,13,21,22,26,27-Octahydro-2,17-dithia[4.4](2,7)pyrenophane
8,27-dithianonacyclo[27.7.1.1(6,34).1(11,19).1(16,24).0(4,35).0(13,18).0(17,22).0(31,36)]tetraconta-1(36),4,6(38),11(40),12,16,18,22,24(39),29(37),30,34-dodecaene |
Wiley ID |
1406453 |