1H-Pyrrole-3-butanoic acid, 4-methyl-2-[(phenylmethoxy)carbonyl]-, methyl ester

SpectraBase Compound ID	2lco9yiCZDo
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 Google Search
Mol Weight	315.37 g/mol
Molecular Formula	C18H21NO4
Exact Mass	315.147058 g/mol

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SpectraBase Spectrum ID	6n7KvkYgJJM
Name	1H-Pyrrole-3-butanoic acid, 4-methyl-2-[(phenylmethoxy)carbonyl]-, methyl ester
Alternate Name(s)	Benzyl 3-(3-methoxycarbonylpropyl)-4-methylpyrrole-2-carboxylate benzyl 3-(4-methoxy-4-oxobutyl)-4-methyl-1H-pyrrole-2-carboxylate
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
Wiley ID	1316037