| SpectraBase Spectrum ID |
5BKHs8dPCjP |
| Name |
Methyl 3,10,18,25-tetrathiapentacyclo[14.14.7.1(32,36).0(12,37).0(27,31)]octatriaconta-1(31),12(37),13,15,27,29,32(38),33,35-nonaene-38-carboxylate |
| Alternate Name(s) |
methyl 7,14,22,29-tetrathiapentacyclo[14.14.7.1(32,36).0(5,31).0(20,37)]octatriaconta-1(31),2,4,16(37),17,19,32(38),33,35-nonaene-38-carboxylate |
| CAS Registry Number |
139524-00-8 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C36H44O2S4 |
| InChI |
InChI=1S/C36H44O2S4/c1-38-36(37)35-31-17-12-18-32(35)34-28-14-11-16-30(34)26-42-22-9-5-4-8-21-41-25-29-15-10-13-27(33(29)31)23-39-19-6-2-3-7-20-40-24-28/h10-18H,2-9,19-26H2,1H3 |
| InChIKey |
UOFFPAHJKDJQAG-UHFFFAOYSA-N |
| Molecular Weight |
636.986 g/mol |
| SMILES |
c1(c2-c3c4CSCCCCCCSCc5c(-c1ccc2)c(CSCCCCCCSCc3ccc4)ccc5)C(=O)OC |
| SPLASH |
splash10-0k9i-0000009000-8dfd8a8546d26bceba74 |
| Source of Spectrum |
U-1992-483-4 |
| Wiley ID |
764173 |
![Methyl 3,10,18,25-tetrathiapentacyclo[14.14.7.1(32,36).0(12,37).0(27,31)]octatriaconta-1(31),12(37),13,15,27,29,32(38),33,35-nonaene-38-carboxylate](/api/spectrum/5BKHs8dPCjP/structure.png?h=300&w=458 "Methyl 3,10,18,25-tetrathiapentacyclo[14.14.7.1(32,36).0(12,37).0(27,31)]octatriaconta-1(31),12(37),13,15,27,29,32(38),33,35-nonaene-38-carboxylate")
