| SpectraBase Spectrum ID |
168vwXvRYG |
| Name |
3-(1,3-Benzodioxol-5-yl)-4-(2-methoxycarbonylethyl)-N-methyl-4-nitropyrrolidine |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H20N2O6 |
| InChI |
InChI=1S/C16H20N2O6/c1-17-8-12(11-3-4-13-14(7-11)24-10-23-13)16(9-17,18(20)21)6-5-15(19)22-2/h3-4,7,12H,5-6,8-10H2,1-2H3/t12-,16-/m1/s1 |
| InChIKey |
QAECIWZKJSKNCK-MLGOLLRUSA-N |
| Molecular Weight |
336.344 g/mol |
| SMILES |
[C@@]1(N(=O)=O)([C@@](c2cc3OCOc3cc2)(CN(C1)C)[H])CCC(=O)OC |
| SPLASH |
splash10-05mo-8951000000-8f187e1c2cac9e3a6e86 |
| Source of Spectrum |
F-51-11494-12 |
| Synonyms |
3-((3S,4S)-4-Benzo[1,3]dioxol-5-yl-1-methyl-3-nitro-pyrrolidin-3-yl)-propionic acid methyl ester
Methyl 3-[4-(1,3-benzodioxol-5-yl)-1-methyl-3-nitro-3-pyrrolidinyl]propanoate |
| Wiley ID |
794017 |
