| SpectraBase Compound ID | JJpWW14HOFV |
|---|---|
| InChI | InChI=1S/C16H13N3O8.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/h1-5,7,9,11,13-15H,6H2;4-6H2,1-3H3/p+1/t9-,11?,13-,14?,15?;/m1./s1 |
| InChIKey | LRVIEOFXZDIXRZ-XCDKZOKBSA-O |
| Mol Weight | 477.49 g/mol |
| Molecular Formula | C22H29N4O8 |
| Exact Mass | 477.198539 g/mol |
15N Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7RGuE0zUJSD |
|---|---|
| Name | LRVIEOFXZDIXRZ-GYNIHCIESA-O |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H29N4O8 |
| InChI | InChI=1S/C16H13N3O8.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/h1-5,7,9,11,13-15H,6H2;4-6H2,1-3H3/p+1/t9-,11?,13-,14?,15?;/m1./s1 |
| InChIKey | LRVIEOFXZDIXRZ-XCDKZOKBSA-O |
| Literature Reference Author | V.MACHACEK,A.LYCKA |
| Literature Reference Citation | COLL.CZ.CH.COMM.,49,244(1984) |
| Literature Reference DOI | 10.1135/cccc19840244 |
| Solvent | DMSO-D6;CR(ACAC)3=10G/L |
| Source File Reference | UWED16581 |