| SpectraBase Compound ID | 1zBiKfpFVao |
|---|---|
| InChI | InChI=1S/C16H12N3O8.C6H15N/c20-12-6-9-10(17(22)23)7-11(18(24)25)13(15(9)19(26)27)14(12)16(21)8-4-2-1-3-5-8;1-4-7(5-2)6-3/h1-5,7,9,13,15H,6H2,(H-,20,21,24,25);4-6H2,1-3H3/q-1;/p+1/t9-,13-,15?;/m1./s1 |
| InChIKey | WNGZVCUKZLIDFW-OPXXADCFSA-O |
| Mol Weight | 476.49 g/mol |
| Molecular Formula | C22H28N4O8 |
| Exact Mass | 476.190714 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1CkrAY4SNnI |
|---|---|
| Name | WNGZVCUKZLIDFW-OPXXADCFSA-O |
| Compound Number | 7B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H28N4O8 |
| InChI | InChI=1S/C16H12N3O8.C6H15N/c20-12-6-9-10(17(22)23)7-11(18(24)25)13(15(9)19(26)27)14(12)16(21)8-4-2-1-3-5-8;1-4-7(5-2)6-3/h1-5,7,9,13,15H,6H2,(H-,20,21,24,25);4-6H2,1-3H3/q-1;/p+1/t9-,13-,15?;/m1./s1 |
| InChIKey | WNGZVCUKZLIDFW-OPXXADCFSA-O |
| Literature Reference Author | V.MACHACEK,A.LYCKA |
| Literature Reference Citation | COLL.CZ.CH.COMM.,49,244(1984) |
| Literature Reference DOI | 10.1135/cccc19840244 |
| Molecular Weight | 476.486 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWCS8330 |