SpectraBase Spectrum ID |
6ZkI6jeM5l8 |
Name |
Benzyl 2-(5,5-dimethyl-1,3-dioxan-2-yl)-3-ethyl-4-methylpyrrole-5-carboxylate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H27NO4 |
InChI |
InChI=1S/C21H27NO4/c1-5-16-14(2)17(19(23)24-11-15-9-7-6-8-10-15)22-18(16)20-25-12-21(3,4)13-26-20/h6-10,20,22H,5,11-13H2,1-4H3 |
InChIKey |
XMNKMGIVHPCCIF-UHFFFAOYSA-N |
Molecular Weight |
357.450 g/mol |
SMILES |
[nH]1c(c(c(c1C1OCC(CO1)(C)C)CC)C)C(=O)OCc1ccccc1 |
SPLASH |
splash10-006x-9344000000-dc603816e805d588a94f |
Source of Spectrum |
SO-1976-465-2 |
Synonyms |
benzyl 5-(5,5-dimethyl-1,3-dioxan-2-yl)-4-ethyl-3-methyl-1H-pyrrole-2-carboxylate |
Wiley ID |
1536934 |