| SpectraBase Compound ID | CyQQDzhn1PK |
|---|---|
| InChI | InChI=1S/C15H21NO6/c1-8(4-3-5-9(2)14(19)20)11-7-16-13(15(21)22)10(11)6-12(17)18/h3-5,9-11,13,16H,6-7H2,1-2H3,(H,17,18)(H,19,20)(H,21,22)/b5-3+,8-4+/t9?,10-,11+,13-/m0/s1 |
| InChIKey | VZFRNCSOCOPNDB-JXMZZWQCSA-N |
| Mol Weight | 311.33 g/mol |
| Molecular Formula | C15H21NO6 |
| Exact Mass | 311.136887 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EdmWGwJjXOy |
|---|---|
| Name | ISODOMOIC-ACID-E |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C15H21NO6 |
| InChI | InChI=1S/C15H21NO6/c1-8(4-3-5-9(2)14(19)20)11-7-16-13(15(21)22)10(11)6-12(17)18/h3-5,9-11,13,16H,6-7H2,1-2H3,(H,17,18)(H,19,20)(H,21,22)/b5-3+,8-4+/t9?,10-,11+,13-/m0/s1 |
| InChIKey | VZFRNCSOCOPNDB-JXMZZWQCSA-N |
| Literature Reference Author | J.L.C.WRIGHT,M.FALK,A.G.MCINNES,J.A.WALTER |
| Literature Reference Citation | CAN.J.CHEM.,68,22(1990) |
| Literature Reference DOI | 10.1139/v90-005 |
| Molecular Weight | 311.335 g/mol |
| Solvent | D2O |
| Source File Reference | UWED13814 |