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3-Cyano-5-oxo-3-methylpyrrolidine, 2-(3,3-dimethyl-2-iodomethylene-3,4(5H)-dihydropyrrol-5-yl)methylene-
SpectraBase Compound ID 8CRDpi0cJNN
InChI InChI=1S/C14H16IN3O/c1-13(2)5-9(17-11(13)7-15)4-10-14(3,8-16)6-12(19)18-10/h4,7H,5-6H2,1-3H3,(H,18,19)/b10-4-,11-7-
InChIKey JLSSBIAABCUDRK-SKLGIOGNSA-N
Mol Weight 369.21 g/mol
Molecular Formula C14H16IN3O
Exact Mass 369.033807 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F7yb2C6hpXI
Name 3-Cyano-5-oxo-3-methylpyrrolidine, 2-(3,3-dimethyl-2-iodomethylene-3,4(5H)-dihydropyrrol-5-yl)methylene-
CAS Registry Number 82471-52-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16IN3O
InChI InChI=1S/C14H16IN3O/c1-13(2)5-9(17-11(13)7-15)4-10-14(3,8-16)6-12(19)18-10/h4,7H,5-6H2,1-3H3,(H,18,19)/b10-4-,11-7-
InChIKey JLSSBIAABCUDRK-SKLGIOGNSA-N
Molecular Weight 369.206 g/mol
SMILES N1C(CC(\C1=C/C=1CC(C)(C)\C(=C\I)N1)(C)C#N)=O
SPLASH splash10-0gdi-5569000000-aaf1018014d2ae28fbc1
Synonyms 3-Cyano-5-methylene-3-methylpyrrolidine, 2-(3,3-dimethyl-2-iodomethylene-3,4(5H)-dihydropyrrol-5-yl)methylene- (2Z)-2-([(2Z)-2-(Iodomethylene)-3,3-dimethyl-3,4-dihydro-2H-pyrrol-5-yl]methylene)-3-methyl-5-oxo-3-pyrrolidinecarbonitrile 5-{[(2Z)-2-(iodomethylene)-3,3-dimethyl-3,4-dihydro-2H-pyrrol-5-yl]methyl}-4-methyl-2-oxo-3,4-dihydro-2H-pyrrole-4-carbonitrile 5-{[2-(iodomethylene)-3,3-dimethyl-3,4-dihydro-2H-pyrrol-5-yl]methyl}-4-methyl-2-oxo-3,4-dihydro-2H-pyrrole-4-carbonitrile
Wiley ID 1479187