![tetrahydro-1H,4H-3a,6a-butanoimidazo[4,5-d]imidazole-2,5-dithione, compound with 1-methyl-2-pyrrolidinone(1:1)](/api/spectrum/ENgrruJQnU7/structure.png?h=300&w=458 "tetrahydro-1H,4H-3a,6a-butanoimidazo[4,5-d]imidazole-2,5-dithione, compound with 1-methyl-2-pyrrolidinone(1:1)")
| SpectraBase Compound ID | 9Qnh3ZVrOgo |
|---|---|
| InChI | InChI=1S/C8H12N4S2.C5H9NO/c13-5-9-7-3-1-2-4-8(7,11-5)12-6(14)10-7;1-6-4-2-3-5(6)7/h1-4H2,(H2,9,11,13)(H2,10,12,14);2-4H2,1H3 |
| InChIKey | LHUHCAZLIKLRPM-UHFFFAOYSA-N |
| Mol Weight | 327.47 g/mol |
| Molecular Formula | C13H21N5OS2 |
| Exact Mass | 327.118753 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ENgrruJQnU7 |
|---|---|
| Name | tetrahydro-1H,4H-3a,6a-butanoimidazo[4,5-d]imidazole-2,5-dithione, compound with 1-methyl-2-pyrrolidinone(1:1) |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H21N5OS2 |
| InChI | InChI=1S/C8H12N4S2.C5H9NO/c13-5-9-7-3-1-2-4-8(7,11-5)12-6(14)10-7;1-6-4-2-3-5(6)7/h1-4H2,(H2,9,11,13)(H2,10,12,14);2-4H2,1H3 |
| InChIKey | LHUHCAZLIKLRPM-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 44926M |
| Solvent | DMSO-d6 |