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1H-Pyrrole-2-carboxylic acid, 5-[(5-ethoxy-2-methyl-2H-pyrrol-2-yl)methyl]-3,4-dimethyl-, 1,1-dimethylethyl ester, (.+-.)-
SpectraBase Compound ID 7gPdGNV1Zd1
InChI InChI=1S/C19H28N2O3/c1-8-23-15-9-10-19(7,21-15)11-14-12(2)13(3)16(20-14)17(22)24-18(4,5)6/h9-10,20H,8,11H2,1-7H3
InChIKey QXAVFQOSBBITAO-UHFFFAOYSA-N
Mol Weight 332.44 g/mol
Molecular Formula C19H28N2O3
Exact Mass 332.209993 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5TgUTik2ae5
Name 1H-Pyrrole-2-carboxylic acid, 5-[(5-ethoxy-2-methyl-2H-pyrrol-2-yl)methyl]-3,4-dimethyl-, 1,1-dimethylethyl ester, (.+-.)-
CAS Registry Number 114090-59-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H28N2O3
InChI InChI=1S/C19H28N2O3/c1-8-23-15-9-10-19(7,21-15)11-14-12(2)13(3)16(20-14)17(22)24-18(4,5)6/h9-10,20H,8,11H2,1-7H3
InChIKey QXAVFQOSBBITAO-UHFFFAOYSA-N
Molecular Weight 332.444 g/mol
SMILES [nH]1c(c(c(c1C(OC(C)(C)C)=O)C)C)CC1(N=C(OCC)C=C1)C
SPLASH splash10-0ufs-4910000000-af0b52ab5a9ebbf37417
Source of Spectrum KC-1987-2041-26
Synonyms t-Butyl 5-(5-ethoxy-2-methyl-2H-pyrrol-2-ylmethyl)-3,4-dimethylpyrrole-2-carboxylate tert-Butyl 5-[(5-ethoxy-2-methyl-2H-pyrrol-2-yl)methyl]-3,4-dimethyl-1H-pyrrole-2-carboxylate
Wiley ID 1329515