| SpectraBase Compound ID | CRNopQKfavl |
|---|---|
| InChI | InChI=1S/C16H24O4/c1-9-5-6-12(17)16(3)8-7-11(14(18)13(9)16)10(2)15(19)20-4/h5,11-14,17-18H,2,6-8H2,1,3-4H3/t11-,12-,13+,14-,16-/m1/s1 |
| InChIKey | AXEGVGVJBISYSU-XYFZXANASA-N |
| Mol Weight | 280.36 g/mol |
| Molecular Formula | C16H24O4 |
| Exact Mass | 280.167459 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5YiMa15fiaF |
|---|---|
| Name | 1-ALPHA,6-ALPHA-DIHYDROXY-ISOCOSTIC-ACID-METHYLESTER |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C16H24O4 |
| InChI | InChI=1S/C16H24O4/c1-9-5-6-12(17)16(3)8-7-11(14(18)13(9)16)10(2)15(19)20-4/h5,11-14,17-18H,2,6-8H2,1,3-4H3/t11-,12-,13+,14-,16-/m1/s1 |
| InChIKey | AXEGVGVJBISYSU-XYFZXANASA-N |
| Literature Reference Author | N.GOEREN |
| Literature Reference Citation | PHYTOCHEM.,38,1261(1995) |
| Literature Reference DOI | 10.1016/0031-9422(94)00746-G |
| Molecular Weight | 280.364 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS3953 |