| SpectraBase Compound ID | CJ9RwVp2Vqi |
|---|---|
| InChI | InChI=1S/C13H23N3O7/c1-11(21,6-17)8(18)13-10(20)15-12(22,9(19)16-13)7(2-4-14)3-5-23-13/h7-8,17-18,21-22H,2-6,14H2,1H3,(H,15,20)(H,16,19)/t7-,8?,11?,12+,13-/m1/s1 |
| InChIKey | KEPDKXRPUBDTFE-FWYSQNTNSA-N |
| Mol Weight | 333.34 g/mol |
| Molecular Formula | C13H23N3O7 |
| Exact Mass | 333.1536 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A5DNj2r5izD |
|---|---|
| Name | 5A-(AMINO)-METHYLDIHYDROBICYCLOMYCIN;MAJOR-DIASTEREOMER |
| Compound Number | 25 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C13H23N3O7 |
| InChI | InChI=1S/C13H23N3O7/c1-11(21,6-17)8(18)13-10(20)15-12(22,9(19)16-13)7(2-4-14)3-5-23-13/h7-8,17-18,21-22H,2-6,14H2,1H3,(H,15,20)(H,16,19)/t7-,8?,11?,12+,13-/m1/s1 |
| InChIKey | KEPDKXRPUBDTFE-FWYSQNTNSA-N |
| Literature Reference Author | F.VINCENT,J.SRINIVASAN,A.SANTILLAN,W.R.WIDGER,H.KOHN |
| Literature Reference Citation | J.ORG.CHEM.,66,2251(2001) |
| Literature Reference DOI | 10.1021/jo0013150 |
| Molecular Weight | 333.342 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU26280 |