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3-[1-Methyl-4-(5-nitrofuran-2-carboxamido)pyrrole-2-carboxamido]propiononitrile
SpectraBase Compound ID AOsVw9mWvGd
InChI InChI=1S/C14H13N5O5/c1-18-8-9(7-10(18)13(20)16-6-2-5-15)17-14(21)11-3-4-12(24-11)19(22)23/h3-4,7-8H,2,6H2,1H3,(H,16,20)(H,17,21)
InChIKey KXPWZDNJVGPSEN-UHFFFAOYSA-N
Mol Weight 331.29 g/mol
Molecular Formula C14H13N5O5
Exact Mass 331.091669 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AcM2nce19GL
Name 3-[1-Methyl-4-(5-nitrofuran-2-carboxamido)pyrrole-2-carboxamido]propiononitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H13N5O5
InChI InChI=1S/C14H13N5O5/c1-18-8-9(7-10(18)13(20)16-6-2-5-15)17-14(21)11-3-4-12(24-11)19(22)23/h3-4,7-8H,2,6H2,1H3,(H,16,20)(H,17,21)
InChIKey KXPWZDNJVGPSEN-UHFFFAOYSA-N
Molecular Weight 331.288 g/mol
SMILES N(c1cc(C(=O)NCCC#N)[n](c1)C)C(c1oc(N(=O)=O)cc1)=O
SPLASH splash10-03dl-0591000000-babbe371031e5b056d1d
Source of Spectrum KC-0-2683-16
Synonyms N-(2-cyanoethyl)-1-methyl-4-[(5-nitro-2-furoyl)amino]-1H-pyrrole-2-carboxamide
Wiley ID 780149