SpectraBase Compound ID | 8ceCQnCBYBU |
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InChI | InChI=1S/2C21H29N3O4/c2*1-2-3-4-5-10-24-15-18(25)19(21(24)27)20(26)22-16-6-8-17(9-7-16)23-11-13-28-14-12-23/h6-9,25H,2-5,10-15H2,1H3,(H,22,26);6-9,22,26H,2-5,10-15H2,1H3/b;20-19+ |
InChIKey | QEHYJCJCVSWCAY-FFWSMYFKSA-N |
Mol Weight | 387.48 g/mol |
Molecular Formula | C21H29N3O4 |
Exact Mass | 387.215806 g/mol |
SpectraBase Spectrum ID | HVCeQvLWVKd |
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Name | AB-TAUTOMER |
Compound Number | 2A |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C21H29N3O4 |
InChI | InChI=1S/2C21H29N3O4/c2*1-2-3-4-5-10-24-15-18(25)19(21(24)27)20(26)22-16-6-8-17(9-7-16)23-11-13-28-14-12-23/h6-9,25H,2-5,10-15H2,1H3,(H,22,26);6-9,22,26H,2-5,10-15H2,1H3/b;20-19+ |
InChIKey | QEHYJCJCVSWCAY-FFWSMYFKSA-N |
Literature Reference Author | Y.C.JEONG,M.G.MOLONEY |
Literature Reference Citation | BEIL.J.ORG.CHEM.,9,1899(2013) |
Literature Reference DOI | 10.3762/bjoc.9.224 |
Molecular Weight | 387.479 g/mol |
Solvent | CDCl3 |
Source File Reference | UWLU77541 |