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Isobutyl-1H-pyrrole-2-carboxylate
SpectraBase Compound ID 2SRI9edcdWh
InChI InChI=1S/C9H13NO2/c1-7(2)6-12-9(11)8-4-3-5-10-8/h3-5,7,10H,6H2,1-2H3
InChIKey UDCZOAOFHCQTNS-UHFFFAOYSA-N
Mol Weight 167.21 g/mol
Molecular Formula C9H13NO2
Exact Mass 167.094629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4jp8kdLWSm
Name Isobutyl-1H-pyrrole-2-carboxylate
Alternate Name(s) Isobutyl 1H-pyrrole-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13NO2
InChI InChI=1S/C9H13NO2/c1-7(2)6-12-9(11)8-4-3-5-10-8/h3-5,7,10H,6H2,1-2H3
InChIKey UDCZOAOFHCQTNS-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol2029993
Molecular Weight 167.208 g/mol
SMILES [nH]1c(ccc1)C(OCC(C)C)=O
SPLASH splash10-01ox-9600000000-b43a5dadb694fae493bb
Source of Spectrum A1-14-468/SMS3-6
Wiley ID 1749957