| SpectraBase Spectrum ID |
BAy3XchU2Cs |
| Name |
(2E)-4-octyl-2-(4-octyl-5,7-dioxo-[1,3]dithiolo[4,5-d]pyrimidin-2-ylidene)-[1,3]dithiolo[4,5-d]pyrimidine-5,7-dione |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H36N4O4S4 |
| InChI |
InChI=1S/C26H36N4O4S4/c1-3-5-7-9-11-13-15-29-21-17(19(31)27-25(29)33)35-23(37-21)24-36-18-20(32)28-26(34)30(22(18)38-24)16-14-12-10-8-6-4-2/h3-16H2,1-2H3,(H,27,31,33)(H,28,32,34)/b24-23+ |
| InChIKey |
GNEBGQSDCUGSKB-WCWDXBQESA-N |
| Instrument Name |
VG Analytical-Autospec EBE |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002_(SICI)1097-0231(19960115)10_1_16 |
| Molecular Weight |
596.838 g/mol |
| SMILES |
N1C(N(C=2S\C(=C/3SC4=C(N(C(NC4=O)=O)CCCCCCCC)S3)SC2C1=O)CCCCCCCC)=O |
| SPLASH |
splash10-0002-2110090000-38253c9bbf6cd19d7649 |
| Source of Spectrum |
RCM-10-17-2d |
| Wiley ID |
1835945 |
![(2E)-4-octyl-2-(4-octyl-5,7-dioxo-[1,3]dithiolo[4,5-d]pyrimidin-2-ylidene)-[1,3]dithiolo[4,5-d]pyrimidine-5,7-dione](/api/spectrum/BAy3XchU2Cs/structure.png?h=300&w=458 "(2E)-4-octyl-2-(4-octyl-5,7-dioxo-[1,3]dithiolo[4,5-d]pyrimidin-2-ylidene)-[1,3]dithiolo[4,5-d]pyrimidine-5,7-dione")
