| SpectraBase Compound ID | J2tuLwlOJFs |
|---|---|
| InChI | InChI=1S/C16H20O7/c1-6(2)8-9(12(17)21-4)15(19)5-7-16(20)13(18)23-11(10(8)22-7)14(15,16)3/h7-11,19-20H,1,5H2,2-4H3/t7-,8?,9?,10+,11-,14+,15+,16?/m0/s1 |
| InChIKey | QYUXGWKGANGESL-YKCHJCKXSA-N |
| Mol Weight | 324.33 g/mol |
| Molecular Formula | C16H20O7 |
| Exact Mass | 324.120903 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9xOq6bCxpLg |
|---|---|
| Name | METHYL-PICROTOXATE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C16H20O7 |
| InChI | InChI=1S/C16H20O7/c1-6(2)8-9(12(17)21-4)15(19)5-7-16(20)13(18)23-11(10(8)22-7)14(15,16)3/h7-11,19-20H,1,5H2,2-4H3/t7-,8?,9?,10+,11-,14+,15+,16?/m0/s1 |
| InChIKey | QYUXGWKGANGESL-YKCHJCKXSA-N |
| Literature Reference Author | S.K.AGARWAL,S.S.SINGH,S.VERMA,S.KUMAR |
| Literature Reference Citation | PHYTOCHEM.,50,1365(1999) |
| Literature Reference DOI | 10.1016/S0031-9422(98)00692-X |
| Molecular Weight | 324.331 g/mol |
| Solvent | Unknown |
| Source File Reference | UWVN1634 |