| SpectraBase Spectrum ID |
94tIIjKdVkm |
| Name |
Ethyl (2S,4S)-4-(4-nitro-1H-indol-3-yl)-6-methoxy-1,2,3,4-tetrahydroquinoline-2-carboxylate |
| Appearance |
Brown oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
395.148120783 u |
| Formula |
C21H21N3O5 |
| InChI |
InChI=1S/C21H21N3O5/c1-3-29-21(25)18-10-13(14-9-12(28-2)7-8-16(14)23-18)15-11-22-17-5-4-6-19(20(15)17)24(26)27/h4-9,11,13,18,22-23H,3,10H2,1-2H3/t13-,18+/m1/s1 |
| InChIKey |
FXKUTXZJERUOHZ-ACJLOTCBSA-N |
| Instrument Name |
Finnigan-MAT-95 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.201701502 |
| Molecular Weight |
395.415 g/mol |
| Quality |
341 |
| Reported Formula |
C21H21O5N3 |
| SMILES |
N1C2=CC=C(C=C2[C@](C2=CNC3=C2C(=CC=C3)[N+]([O-])=O)(C[C@]1(C(=O)OCC)[H])[H])OC |
| SPLASH |
splash10-0592-1239000000-69859b526b69489847de |
| Source of Spectrum |
K1-2018-SM23-16de (DOI: 10.1002/ejoc.201701502) |
| Wiley ID |
1891527 |
