| SpectraBase Spectrum ID |
2uOtkhU4Xo |
| Name |
Benzenepropanoic acid, .alpha.-hydroxy-, 6-hydroxy-7-[(2-methyl-1-oxo-2-butenyl)oxy]-8-azabicyclo[3.2.1]oct-3- yl ester |
| CAS Registry Number |
66759-84-0 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H27NO6 |
| InChI |
InChI=1S/C21H27NO6/c1-3-12(2)20(25)28-19-15-11-18(14(22-15)10-16(19)23)27-21(26)17(24)9-13-7-5-4-6-8-13/h3-8,14-19,22-24H,9-11H2,1-2H3/b12-3+/t14-,15-,16?,17?,18?,19?/m1/s1 |
| InChIKey |
FEEAAOSCAMEYLR-KGVSQERTSA-N |
| Molecular Weight |
389.448 g/mol |
| SMILES |
N1[C@]2(C(C[C@@]1(C(C(C2)O)OC(\C(=C\C)C)=O)[H])OC(C(Cc1ccccc1)O)=O)[H] |
| SPLASH |
splash10-001i-9810000000-fe690525a968f4c17f57 |
| Source of Spectrum |
B-31-1164-0 |
| Synonyms |
(+)-7-Hydroxy-6-tigloyloxynortropan-3-yl 2-hydroxy-3-phenyl propionate
3-Hydroxy-6-[(2-hydroxy-3-phenylpropanoyl)oxy]-8-azabicyclo[3.2.1]oct-2-yl (2E)-2-methyl-2-butenoate |
| Wiley ID |
1364341 |
![Benzenepropanoic acid, .alpha.-hydroxy-, 6-hydroxy-7-[(2-methyl-1-oxo-2-butenyl)oxy]-8-azabicyclo[3.2.1]oct-3- yl ester](/api/spectrum/2uOtkhU4Xo/structure.png?h=300&w=458 "Benzenepropanoic acid, .alpha.-hydroxy-, 6-hydroxy-7-[(2-methyl-1-oxo-2-butenyl)oxy]-8-azabicyclo[3.2.1]oct-3- yl ester")
