| SpectraBase Compound ID | KcDTs64fjuY |
|---|---|
| InChI | InChI=1S/C12H16N4O4/c1-12(2)19-7-5-3-14-10-6(9(13)17)15-4-16(10)11(18-5)8(7)20-12/h4-5,7-8,11,14H,3H2,1-2H3,(H2,13,17)/t5-,7?,8?,11-/m0/s1 |
| InChIKey | LMECWJMQLQSERO-HOTPFXFGSA-N |
| Mol Weight | 280.28 g/mol |
| Molecular Formula | C12H16N4O4 |
| Exact Mass | 280.117155 g/mol |
15N Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GinBTWlRATI |
|---|---|
| Name | LMECWJMQLQSERO-HOTPFXFGSA-N |
| CAS Registry Number | 21017-07-2 |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C12H16N4O4 |
| InChI | InChI=1S/C12H16N4O4/c1-12(2)19-7-5-3-14-10-6(9(13)17)15-4-16(10)11(18-5)8(7)20-12/h4-5,7-8,11,14H,3H2,1-2H3,(H2,13,17)/t5-,7?,8?,11-/m0/s1 |
| InChIKey | LMECWJMQLQSERO-HOTPFXFGSA-N |
| Literature Reference Author | J.UZAWA,K.ANZAI |
| Literature Reference Citation | LIEB.ANN.CHEM.,1195(1988) |
| Solvent | DMSO |
| Source File Reference | UWCS18276 |