| SpectraBase Spectrum ID |
B0l3BDIIxKC |
| Name |
(8R,9S)-9-Isobutyryloxyruban-3-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H26N2O4 |
| InChI |
InChI=1S/C22H26N2O4/c1-13(2)22(26)28-21(19-10-14-7-9-24(19)12-20(14)25)16-6-8-23-18-5-4-15(27-3)11-17(16)18/h4-6,8,11,13-14,19,21H,7,9-10,12H2,1-3H3/t14-,19+,21+/m1/s1 |
| InChIKey |
QCAAVTUXWXLEKD-RFVSGWPVSA-N |
| Molecular Weight |
382.460 g/mol |
| SMILES |
[C@]1(N2CC[C@](C1)(C(C2)=O)[H])([C@@](OC(=O)C(C)C)(c1c2c(ccc(c2)OC)ncc1)[H])[H] |
| SPLASH |
splash10-0gb9-0394000000-80b99f10a56e14b10f28 |
| Source of Spectrum |
KC-0-803-1 |
| Synonyms |
(S)-(6-methoxy-4-quinolinyl)[(2R)-5-oxo-1-azabicyclo[2.2.2]oct-2-yl]methyl 2-methylpropanoate
Isobutyric acid (S)-(6-methoxy-quinolin-4-yl)-((R)-5-oxo-1-aza-bicyclo[2.2.2]oct-2-yl)-methyl ester |
| Wiley ID |
824911 |
