| SpectraBase Spectrum ID |
F6j35FBCXLw |
| Name |
Malonic acid mono-[(R)-1-(1,4,6,7,12,12b-hexahydro-indolo[2,3-a]quinolizin-3-yl)-ethyl]ester |
| Alternate Name(s) |
2(R)-[1-(Carboxymethylcarbonyloxy)ethyl]hexhydropyridino[2,1-a].beta.-carboline
3-{[(1R)-1-(1,4,6,7,12,12b-hexahydroindolo[2,3-a]quinolizin-3-yl)ethyl]oxy}-3-oxopropanoic acid |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H22N2O4 |
| InChI |
InChI=1S/C20H22N2O4/c1-12(26-19(25)10-18(23)24)13-6-7-17-20-15(8-9-22(17)11-13)14-4-2-3-5-16(14)21-20/h2-6,12,17,21H,7-11H2,1H3,(H,23,24)/t12-,17?/m1/s1 |
| InChIKey |
JVCLRPQPWHLSRL-MTATWXBHSA-N |
| Molecular Weight |
354.406 g/mol |
| SMILES |
[nH]1c2ccccc2c2CCN3C(CC=C([C@](OC(CC(=O)O)=O)(C)[H])C3)c12 |
| SPLASH |
splash10-00di-0900000000-fc1e2c1d0bd4a5c011ba |
| Source of Spectrum |
H1-43-1986-17 |
| Wiley ID |
757946 |
![Malonic acid mono-[(R)-1-(1,4,6,7,12,12b-hexahydro-indolo[2,3-a]quinolizin-3-yl)-ethyl]ester](/api/spectrum/F6j35FBCXLw/structure.png?h=300&w=458 "Malonic acid mono-[(R)-1-(1,4,6,7,12,12b-hexahydro-indolo[2,3-a]quinolizin-3-yl)-ethyl]ester")
