| SpectraBase Spectrum ID |
CFsPCa54zrJ |
| Name |
3-(3-Keto-3-methoxy-propyl)-4-methyl-5-(2-nitroethyl)-1H-pyrrole-2-carboxylic acid tert-butyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
340.163436495 u |
| Formula |
C16H24N2O6 |
| InChI |
InChI=1S/C16H24N2O6/c1-10-11(6-7-13(19)23-5)14(15(20)24-16(2,3)4)17-12(10)8-9-18(21)22/h17H,6-9H2,1-5H3 |
| InChIKey |
XHPKRXFXEYBDGZ-UHFFFAOYSA-N |
| Molecular Weight |
340.376 g/mol |
| SMILES |
C=1(NC(CCN(=O)=O)=C(C1CCC(=O)OC)C)C(OC(C)(C)C)=O |
