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5-[Cyano(5-methoxycarbonylpyrrolidin-2-ylidene)methyl]-3,4-dihydro-2H-pyrrole-2-carboxylic acid, methyl ester
SpectraBase Compound ID 3WUUcIOw9XS
InChI InChI=1S/C14H17N3O4/c1-20-13(18)11-5-3-9(16-11)8(7-15)10-4-6-12(17-10)14(19)21-2/h11-12,16H,3-6H2,1-2H3/b9-8+
InChIKey HEMMGWQVSFWCAQ-CMDGGOBGSA-N
Mol Weight 291.31 g/mol
Molecular Formula C14H17N3O4
Exact Mass 291.121906 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7ygzPEJjdHE
Name 5-[Cyano(5-methoxycarbonylpyrrolidin-2-ylidene)methyl]-3,4-dihydro-2H-pyrrole-2-carboxylic acid, methyl ester
CAS Registry Number 105251-49-8
Comments Structure changed after expert review
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17N3O4
InChI InChI=1S/C14H17N3O4/c1-20-13(18)11-5-3-9(16-11)8(7-15)10-4-6-12(17-10)14(19)21-2/h11-12,16H,3-6H2,1-2H3/b9-8+
InChIKey HEMMGWQVSFWCAQ-CMDGGOBGSA-N
Molecular Weight 291.307 g/mol
SMILES N1\C(CCC1C(=O)OC)=C/(C#N)C1=NC(C(=O)OC)CC1
SPLASH splash10-001i-3690000000-0d28ba81325db54f2deb
Synonyms Methyl 5-((Z)-cyano[5-(methoxycarbonyl)-2-pyrrolidinylidene]methyl)-3,4-dihydro-2H-pyrrole-2-carboxylate Methyl 5-{cyano[2-(methoxycarbonyl)-3,4-dihydro-2H-pyrrol-5-yl]methylidene}prolinate 5-[(Z)-cyano-(5-methoxycarbonyl-2-pyrrolidinylidene)methyl]-3,4-dihydro-2H-pyrrole-2-carboxylic acid methyl ester Methyl 5-[(Z)-cyano-(5-methoxycarbonylpyrrolidin-2-ylidene)methyl]-3,4-dihydro-2H-pyrrole-2-carboxylate 5-[(Z)-(5-carbomethoxypyrrolidin-2-ylidene)-cyano-methyl]-1-pyrroline-2-carboxylic acid methyl ester
Wiley ID 1480665