| SpectraBase Spectrum ID |
JSfvWGYFq8 |
| Name |
Benzyl 2-acetyl-4-[2-(methoxycarbonyl)ethyl]-3-[(methoxycarbonyl)methyl]pyrrole-5-carboxylate |
| Alternate Name(s) |
benzyl 5-acetyl-4-(2-methoxy-2-oxoethyl)-3-(3-methoxy-3-oxopropyl)-1H-pyrrole-2-carboxylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H23NO7 |
| InChI |
InChI=1S/C21H23NO7/c1-13(23)19-16(11-18(25)28-3)15(9-10-17(24)27-2)20(22-19)21(26)29-12-14-7-5-4-6-8-14/h4-8,22H,9-12H2,1-3H3 |
| InChIKey |
AGGIRJQQRLCCMV-UHFFFAOYSA-N |
| Molecular Weight |
401.415 g/mol |
| SMILES |
[nH]1c(c(c(c1C(=O)C)CC(=O)OC)CCC(=O)OC)C(OCc1ccccc1)=O |
| SPLASH |
splash10-0006-9000000000-0c7c3612564699410e3b |
| Source of Spectrum |
F-48-4706-24 |
| Wiley ID |
1369962 |
![Benzyl 2-acetyl-4-[2-(methoxycarbonyl)ethyl]-3-[(methoxycarbonyl)methyl]pyrrole-5-carboxylate](/api/spectrum/JSfvWGYFq8/structure.png?h=300&w=458 "Benzyl 2-acetyl-4-[2-(methoxycarbonyl)ethyl]-3-[(methoxycarbonyl)methyl]pyrrole-5-carboxylate")
