| SpectraBase Spectrum ID |
8T9pFXVicUB |
| Name |
5,5'-(1,4-Phenylenebis(1-methyl-2,4-dioxo-2,3,4,7-tetrahydro-1H-pyrrolo[2,3-d]pyrimidine-6,5-diyl))bis(1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione) |
| Appearance |
Pale yellow powder |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C32H28N10O10 |
| InChI |
InChI=1S/C32H28N10O10/c1-37-21-15(23(43)35-29(37)49)13(17-25(45)39(3)31(51)40(4)26(17)46)19(33-21)11-7-9-12(10-8-11)20-14(16-22(34-20)38(2)30(50)36-24(16)44)18-27(47)41(5)32(52)42(6)28(18)48/h7-10,17-18,33-34H,1-6H3,(H,35,43,49)(H,36,44,50) |
| InChIKey |
PVRQJJHMZWUEHR-UHFFFAOYSA-N |
| Instrument Name |
Agilent 5975C VL MSD |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhet.3320 |
| Molecular Weight |
712.636 g/mol |
| Reported Formula |
C32H28N10O10 |
| SMILES |
N1C(c2c(c(-c3ccc(-c4c(c5c(N(C(NC5=O)=O)C)[nH]4)C4C(N(C(N(C4=O)C)=O)C)=O)cc3)[nH]c2N(C1=O)C)C1C(N(C(N(C1=O)C)=O)C)=O)=O |
| SPLASH |
splash10-0a4l-9222120000-7cdc58eb823ef685a4c6 |
| Source of Spectrum |
Y-55-SM14-5d |
| Wiley ID |
1878911 |
![5,5'-(1,4-Phenylenebis(1-methyl-2,4-dioxo-2,3,4,7-tetrahydro-1H-pyrrolo[2,3-d]pyrimidine-6,5-diyl))bis(1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione)](/api/spectrum/8T9pFXVicUB/structure.png?h=300&w=458 "5,5'-(1,4-Phenylenebis(1-methyl-2,4-dioxo-2,3,4,7-tetrahydro-1H-pyrrolo[2,3-d]pyrimidine-6,5-diyl))bis(1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione)")
