](/api/spectrum/7jKwZ4oPRmm/structure.png?h=300&w=458 "NITRILOTRIACETIC-ACID-[ASP-(ONA)-(ONA)](3)")
| SpectraBase Compound ID | 7aT4ktInDz7 |
|---|---|
| InChI | InChI=1S/C18H24N4O15.6Na/c23-10(19-7(16(32)33)1-13(26)27)4-22(5-11(24)20-8(17(34)35)2-14(28)29)6-12(25)21-9(18(36)37)3-15(30)31;;;;;;/h7-9H,1-6H2,(H,19,23)(H,20,24)(H,21,25)(H,26,27)(H,28,29)(H,30,31)(H,32,33)(H,34,35)(H,36,37);;;;;;/q;6*+1/p-6 |
| InChIKey | HATULRPNDLIGON-UHFFFAOYSA-H |
| Mol Weight | 668.29361569 g/mol |
| Molecular Formula | C18H18N4Na6O15 |
| Exact Mass | 668.015482 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7jKwZ4oPRmm |
|---|---|
| Name | NITRILOTRIACETIC-ACID-[ASP-(ONA)-(ONA)](3) |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C18H18N4Na6O15 |
| InChI | InChI=1S/C18H24N4O15.6Na/c23-10(19-7(16(32)33)1-13(26)27)4-22(5-11(24)20-8(17(34)35)2-14(28)29)6-12(25)21-9(18(36)37)3-15(30)31;;;;;;/h7-9H,1-6H2,(H,19,23)(H,20,24)(H,21,25)(H,26,27)(H,28,29)(H,30,31)(H,32,33)(H,34,35)(H,36,37);;;;;;/q;6*+1/p-6 |
| InChIKey | HATULRPNDLIGON-UHFFFAOYSA-H |
| Literature Reference Author | M.SCHULTZ,J.KULIS,J.MURISON,G.W.ANDREWS |
| Literature Reference Citation | AUSTR.J.CHEM.,61,297(2008) |
| Literature Reference DOI | 10.1071/ch07430 |
| Molecular Weight | 668.297 g/mol |
| Sample ID | 40510 |
| Solvent | D2O |