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(E)-methyl 2-(1H-pyrrol-2-yl)but-2-enoate
SpectraBase Compound ID ARUj3hKrXid
InChI InChI=1S/C9H11NO2/c1-3-7(9(11)12-2)8-5-4-6-10-8/h3-6,10H,1-2H3/b7-3+
InChIKey CIOVRBARUKCNKE-XVNBXDOJSA-N
Mol Weight 165.19 g/mol
Molecular Formula C9H11NO2
Exact Mass 165.078979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C0jBqxkFRuX
Name (E)-methyl 2-(1H-pyrrol-2-yl)but-2-enoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H11NO2
InChI InChI=1S/C9H11NO2/c1-3-7(9(11)12-2)8-5-4-6-10-8/h3-6,10H,1-2H3/b7-3+
InChIKey CIOVRBARUKCNKE-XVNBXDOJSA-N
Literature Reference DOI 10.1039/C6RA05348C
Molecular Weight 165.192 g/mol
SMILES [nH]1c(ccc1)\C(=C/C)C(OC)=O
SPLASH splash10-0pdi-2900000000-055412294017a31c7e30
Source of Spectrum RSA-6-44341/SM2-(E)_4ba
Synonyms Methyl (E)-2-(1H-pyrrol-2-yl)but-2-enoate
Wiley ID 1807178