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5-[Cyano-(4,5-dihydro-3H-pyrrol-2-yl)-methylene]pyrrolidine-2-carboxylic acid, methyl ester
SpectraBase Compound ID 4q9SqzVKxkP
InChI InChI=1S/C12H15N3O2/c1-17-12(16)11-5-4-10(15-11)8(7-13)9-3-2-6-14-9/h11,15H,2-6H2,1H3/b10-8+
InChIKey SFAOZCGZHHZSIF-CSKARUKUSA-N
Mol Weight 233.27 g/mol
Molecular Formula C12H15N3O2
Exact Mass 233.116427 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JLdnpHc4Kem
Name 5-[Cyano-(4,5-dihydro-3H-pyrrol-2-yl)-methylene]pyrrolidine-2-carboxylic acid, methyl ester
Alternate Name(s) Methyl (5Z)-5-[cyano(3,4-dihydro-2H-pyrrol-5-yl)methylene]-2-pyrrolidinecarboxylate Methyl (5Z)-5-[cyano(3,4-dihydro-2H-pyrrol-5-yl)methylidene]pyrrolidine-2-carboxylate
Comments Structure changed after expert review
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15N3O2
InChI InChI=1S/C12H15N3O2/c1-17-12(16)11-5-4-10(15-11)8(7-13)9-3-2-6-14-9/h11,15H,2-6H2,1H3/b10-8+
InChIKey SFAOZCGZHHZSIF-CSKARUKUSA-N
Molecular Weight 233.271 g/mol
SMILES N1\C(CCC1C(=O)OC)=C/(C#N)C1=NCCC1
SPLASH splash10-00di-1910000000-96556ee740c87b7e7f0f
Wiley ID 1486914