| SpectraBase Compound ID | 4chlTQRwpjv |
|---|---|
| InChI | InChI=1S/C22H16O12/c1-8-5-12(24)10(6-23)19-15(8)22(31)34-20-11(7-32-14(27)4-3-13(25)26)17(28)16(21(29)30)9(2)18(20)33-19/h3-6,24,28H,7H2,1-2H3,(H,25,26)(H,29,30)/b4-3+ |
| InChIKey | VEGGRTFDFMUBPD-ONEGZZNKSA-N |
| Mol Weight | 472.36 g/mol |
| Molecular Formula | C22H16O12 |
| Exact Mass | 472.064176 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BrPIP9OaucU |
|---|---|
| Name | FUMARPROTOCETRARINSAEURE |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H16O12 |
| InChI | InChI=1S/C22H16O12/c1-8-5-12(24)10(6-23)19-15(8)22(31)34-20-11(7-32-14(27)4-3-13(25)26)17(28)16(21(29)30)9(2)18(20)33-19/h3-6,24,28H,7H2,1-2H3,(H,25,26)(H,29,30)/b4-3+ |
| InChIKey | VEGGRTFDFMUBPD-ONEGZZNKSA-N |
| Literature Reference Author | E.G.SUNDHOLM,S.HUNECK |
| Literature Reference Citation | CHEM.SCRIPTA,18,233(1981) |
| Molecular Weight | 472.362 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UNIW21738 |