| SpectraBase Compound ID | Kbnnpodlus6 |
|---|---|
| InChI | InChI=1S/C23H28N2O5/c1-13-18-11-25(2)8-7-16-15-6-5-14(28-3)9-20(15)24-22(16)21(26)10-17(18)19(12-30-13)23(27)29-4/h5-6,9,12-13,17-18,24H,7-8,10-11H2,1-4H3/t13-,17-,18-/m0/s1 |
| InChIKey | XGECXYOCJYLMHQ-KKXDTOCCSA-N |
| Mol Weight | 412.49 g/mol |
| Molecular Formula | C23H28N2O5 |
| Exact Mass | 412.199822 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 90BTREW3kaH |
|---|---|
| Name | 11-Methoxypycraphylline |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H28N2O5 |
| InChI | InChI=1S/C23H28N2O5/c1-13-18-11-25(2)8-7-16-15-6-5-14(28-3)9-20(15)24-22(16)21(26)10-17(18)19(12-30-13)23(27)29-4/h5-6,9,12-13,17-18,24H,7-8,10-11H2,1-4H3/t13-,17-,18-/m0/s1 |
| InChIKey | XGECXYOCJYLMHQ-KKXDTOCCSA-N |
| Molecular Weight | 412.486 g/mol |
| SMILES | [nH]1c2cc(ccc2c2CCN(C[C@]3([C@@](OC=C([C@]3(CC(c12)=O)[H])C(=O)OC)(C)[H])[H])C)OC |
| SPLASH | splash10-00di-3930200000-7ceae8f588dc9830bd22 |
| Source of Spectrum | X2-44-198-22 |
| Wiley ID | 1600848 |