| SpectraBase Compound ID | E0IKhA2RipR |
|---|---|
| InChI | InChI=1S/C21H31NO11S/c1-6-9-29-21(27)22-17-19(32-14(4)25)18(31-13(3)24)15(11-30-12(2)23)33-20(17)34-10-7-8-16(26)28-5/h6,15,17-20H,1,7-11H2,2-5H3,(H,22,27)/t15-,17-,18-,19-,20+/m1/s1 |
| InChIKey | JODXOSAKJLFMTN-RUGGUXRKSA-N |
| Mol Weight | 505.54 g/mol |
| Molecular Formula | C21H31NO11S |
| Exact Mass | 505.161782 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5EwOmjFU7WV |
|---|---|
| Name | JODXOSAKJLFMTN-RUGGUXRKSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H31NO11S |
| InChI | InChI=1S/C21H31NO11S/c1-6-9-29-21(27)22-17-19(32-14(4)25)18(31-13(3)24)15(11-30-12(2)23)33-20(17)34-10-7-8-16(26)28-5/h6,15,17-20H,1,7-11H2,2-5H3,(H,22,27)/t15-,17-,18-,19-,20+/m1/s1 |
| InChIKey | JODXOSAKJLFMTN-RUGGUXRKSA-N |
| Literature Reference Author | ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ |
| Literature Reference Citation | UNI_MAINZ,INTERNAL_DB(2006) |
| Molecular Weight | 505.537 g/mol |
| Source File Reference | MHKO20491 |