| SpectraBase Compound ID | BytAlwLcy1B |
|---|---|
| InChI | InChI=1S/C20H22N2O4/c1-11-13-9-22-7-6-20(15-4-2-3-5-16(15)21-19(20)25)17(22)8-12(13)14(10-26-11)18(23)24/h2-5,10-13,17H,6-9H2,1H3,(H,21,25)(H,23,24)/t11-,12+,13+,17+,20+/m1/s1 |
| InChIKey | BLXUPISDXRFTCK-VVYZVHOJSA-N |
| Mol Weight | 354.41 g/mol |
| Molecular Formula | C20H22N2O4 |
| Exact Mass | 354.157957 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ObqnJo4wQD |
|---|---|
| Name | RAUNITICINIC-ALLO-ACID-B |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H22N2O4 |
| InChI | InChI=1S/C20H22N2O4/c1-11-13-9-22-7-6-20(15-4-2-3-5-16(15)21-19(20)25)17(22)8-12(13)14(10-26-11)18(23)24/h2-5,10-13,17H,6-9H2,1H3,(H,21,25)(H,23,24)/t11-,12+,13+,17+,20+/m1/s1 |
| InChIKey | BLXUPISDXRFTCK-VVYZVHOJSA-N |
| Literature Reference Author | F.SALIM,N.H.ISMAIL,K.AWANG,R.AHMAD |
| Literature Reference Citation | MOLECULES,16,6541(2011) |
| Literature Reference DOI | 10.3390/molecules16086541 |
| Molecular Weight | 354.406 g/mol |
| Sample ID | 31 |
| Solvent | CDCl3 |