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2-Butenedioic acid, 2-(1H-pyrrol-2-yl)-, dimethyl ester, (E)-
SpectraBase Compound ID G2qCzYisKV3
InChI InChI=1S/C10H11NO4/c1-14-9(12)6-7(10(13)15-2)8-4-3-5-11-8/h3-6,11H,1-2H3/b7-6+
InChIKey OPWPHCGQQWXQRN-VOTSOKGWSA-N
Mol Weight 209.2 g/mol
Molecular Formula C10H11NO4
Exact Mass 209.068808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8rKdsaPnldu
Name 2-Butenedioic acid, 2-(1H-pyrrol-2-yl)-, dimethyl ester, (E)-
CAS Registry Number 66653-25-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H11NO4
InChI InChI=1S/C10H11NO4/c1-14-9(12)6-7(10(13)15-2)8-4-3-5-11-8/h3-6,11H,1-2H3/b7-6+
InChIKey OPWPHCGQQWXQRN-VOTSOKGWSA-N
Molecular Weight 209.201 g/mol
SMILES [nH]1cccc1\C(=C/C(=O)OC)C(=O)OC
SPLASH splash10-0pxu-3950000000-db6fad33cf4ea13582a6
Source of Spectrum J-43-3728-0
Synonyms Fumaric acid, pyrrol-2-yl-, dimethyl ester Dimethyl (2E)-2-(1H-pyrrol-2-yl)-2-butenedioate Dimethyl (E)-pyrrol-2-ylbutenedionate (E)-2-(1H-pyrrol-2-yl)-2-butenedioic acid dimethyl ester Dimethyl (E)-2-(1H-pyrrol-2-yl)but-2-enedioate
Wiley ID 1207962