| SpectraBase Spectrum ID |
2xA4UR2uIfu |
| Name |
Bis(methylthio)[2.2](3,3')-biphenylophane |
| Alternate Name(s) |
7,8-bis(methylsulfanyl)pentacyclo[19.3.1.1(2,6).1(9,13).1(14,18)]octacosa-1(25),2(28),3,5,9(27),10,12,14(26),15,17,21,23-dodecaene |
| CAS Registry Number |
66008-63-7 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C30H28S2 |
| InChI |
InChI=1S/C30H28S2/c1-31-29-27-13-5-11-25(19-27)23-9-3-7-21(17-23)15-16-22-8-4-10-24(18-22)26-12-6-14-28(20-26)30(29)32-2/h3-14,17-20,29-30H,15-16H2,1-2H3 |
| InChIKey |
AEAGNHIVJQLNDM-UHFFFAOYSA-N |
| Molecular Weight |
452.674 g/mol |
| SMILES |
C1(C(c2cc(-c3cc(CCc4cc(-c5cc1ccc5)ccc4)ccc3)ccc2)SC)SC |
| SPLASH |
splash10-017i-0900100000-f34ae423498bf4bbdfe0 |
| Source of Spectrum |
J-43-2486-0 |
| Wiley ID |
1388391 |
-biphenylophane](/api/spectrum/2xA4UR2uIfu/structure.png?h=300&w=458 "Bis(methylthio)[2.2](3,3')-biphenylophane")
