| SpectraBase Compound ID | 3ML5QzFIFmM |
|---|---|
| InChI | InChI=1S/C22H30N2O7/c1-15(22(30)31)12-19(26)24-21(29)17-14-23-16(13-18(17)25)10-8-6-4-2-3-5-7-9-11-20(27)28/h8,10,13-15H,2-7,9,11-12H2,1H3,(H,23,25)(H,27,28)(H,30,31)(H,24,26,29)/b10-8-/t15-/m0/s1 |
| InChIKey | NJUIBIWJAXMJKR-WWRUEGTHSA-N |
| Mol Weight | 434.49 g/mol |
| Molecular Formula | C22H30N2O7 |
| Exact Mass | 434.205301 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1nRuj3Ft9WS |
|---|---|
| Name | HIMEIC-ACID-E |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H30N2O7 |
| InChI | InChI=1S/C22H30N2O7/c1-15(22(30)31)12-19(26)24-21(29)17-14-23-16(13-18(17)25)10-8-6-4-2-3-5-7-9-11-20(27)28/h8,10,13-15H,2-7,9,11-12H2,1H3,(H,23,25)(H,27,28)(H,30,31)(H,24,26,29)/b10-8-/t15-/m0/s1 |
| InChIKey | NJUIBIWJAXMJKR-WWRUEGTHSA-N |
| Literature Reference Author | T.KUWANA,M.MIYAZAKI,H.KATO,S.TSUKAMOTO |
| Literature Reference Citation | CHEM.PHARM.BULL.,61,105(2013) |
| Literature Reference DOI | 10.1248/cpb.c12-00800 |
| Molecular Weight | 434.489 g/mol |
| Source File Reference | UWBT4834 |