| SpectraBase Spectrum ID |
8MDFSU5dhEF |
| Name |
[2beta-(Chloromethyl)-1,2,3,4,6,7,12,12bbeta-octahydro-4-oxoindolo[2,3-a]quinolizin-3beta-ylmethyl]malonic acid di-tert-butylester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H37ClN2O5 |
| InChI |
InChI=1S/C28H37ClN2O5/c1-27(2,3)35-25(33)20(26(34)36-28(4,5)6)14-19-16(15-29)13-22-23-18(11-12-31(22)24(19)32)17-9-7-8-10-21(17)30-23/h7-10,16,19-20,22,30H,11-15H2,1-6H3/t16-,19+,22-/m1/s1 |
| InChIKey |
QWUOIDGUYGQION-GTCCEBARSA-N |
| Literature Reference DOI |
10.1002/cber.19811140528 |
| Molecular Weight |
517.066 g/mol |
| SMILES |
[nH]1c2c(c3CCN4[C@](c13)([H])C[C@@]([C@@](C4=O)(CC(C(OC(C)(C)C)=O)C(OC(C)(C)C)=O)[H])(CCl)[H])cccc2 |
| SPLASH |
splash10-0zfu-0343920000-1025c2cf6f0f3cd469b7 |
| Source of Spectrum |
K-114-1921-6k |
| Synonyms |
di-tert-butyl 2-(((2S,3S,12bR)-2-(chloromethyl)-4-oxo-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-3-yl)methyl)malonate |
| Wiley ID |
1791871 |
![[2beta-(Chloromethyl)-1,2,3,4,6,7,12,12bbeta-octahydro-4-oxoindolo[2,3-a]quinolizin-3beta-ylmethyl]malonic acid di-tert-butylester](/api/spectrum/8MDFSU5dhEF/structure.png?h=300&w=458 "[2beta-(Chloromethyl)-1,2,3,4,6,7,12,12bbeta-octahydro-4-oxoindolo[2,3-a]quinolizin-3beta-ylmethyl]malonic acid di-tert-butylester")
