| SpectraBase Compound ID | 3wbnLXtfehL |
|---|---|
| InChI | InChI=1S/C10H8BrN3O7/c1-4(15)12-6-3-7(13(17)18)8(11)9(14(19)20)10(6)21-5(2)16/h3H,1-2H3,(H,12,15) |
| InChIKey | VTHZCRXEFUPBJP-UHFFFAOYSA-N |
| Mol Weight | 362.09 g/mol |
| Molecular Formula | C10H8BrN3O7 |
| Exact Mass | 360.954563 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8cJJPspWjfL |
|---|---|
| Name | ISOMER-1 |
| Compound Number | 836 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C10H8BrN3O7 |
| InChI | InChI=1S/C10H8BrN3O7/c1-4(15)12-6-3-7(13(17)18)8(11)9(14(19)20)10(6)21-5(2)16/h3H,1-2H3,(H,12,15) |
| InChIKey | VTHZCRXEFUPBJP-UHFFFAOYSA-N |
| Literature Reference Author | W.ROBIEN |
| Literature Reference Citation | W.ROBIEN,PRIVATE_COMMUNICATION |
| Molecular Weight | 362.093 g/mol |
| Sample ID | 12 |
| Solvent | DMSO |