SpectraBase Spectrum ID |
6n7KvkYgJJM |
Name |
1H-Pyrrole-3-butanoic acid, 4-methyl-2-[(phenylmethoxy)carbonyl]-, methyl ester |
CAS Registry Number |
99602-65-0 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H21NO4 |
InChI |
InChI=1S/C18H21NO4/c1-13-11-19-17(15(13)9-6-10-16(20)22-2)18(21)23-12-14-7-4-3-5-8-14/h3-5,7-8,11,19H,6,9-10,12H2,1-2H3 |
InChIKey |
ABRDXQQMOCKKTI-UHFFFAOYSA-N |
Molecular Weight |
315.369 g/mol |
SMILES |
[nH]1cc(c(c1C(OCc1ccccc1)=O)CCCC(=O)OC)C |
SPLASH |
splash10-00kf-8029000000-b057dee7239f48fcc85f |
Source of Spectrum |
KC-1985-1704-19 |
Synonyms |
Benzyl 3-(3-methoxycarbonylpropyl)-4-methylpyrrole-2-carboxylate
benzyl 3-(4-methoxy-4-oxobutyl)-4-methyl-1H-pyrrole-2-carboxylate |
Wiley ID |
1316037 |