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2-Isocyano-3,3-diphenyl-1-(pyrrolidin-1-yl)prop-2-en-1-one
SpectraBase Compound ID CTh0mz4KFgE
InChI InChI=1S/C20H18N2O/c21-15-18(20(23)22-13-7-8-14-22)19(16-9-3-1-4-10-16)17-11-5-2-6-12-17/h1-6,9-12H,7-8,13-14H2
InChIKey RGVFCZSBVMJBLY-UHFFFAOYSA-N
Mol Weight 302.38 g/mol
Molecular Formula C20H18N2O
Exact Mass 302.141913 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1CeTScuHxI
Name 2-Isocyano-3,3-diphenyl-1-(pyrrolidin-1-yl)prop-2-en-1-one
Alternate Name(s) 3,3-Diphenyl-2-(pyrrolidine-1-carbonyl)acrylonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H18N2O
InChI InChI=1S/C20H18N2O/c21-15-18(20(23)22-13-7-8-14-22)19(16-9-3-1-4-10-16)17-11-5-2-6-12-17/h1-6,9-12H,7-8,13-14H2
InChIKey RGVFCZSBVMJBLY-UHFFFAOYSA-N
Literature Reference DOI 10.1039/c4cc06427e
Molecular Weight 302.377 g/mol
SMILES c1(C(c2ccccc2)=C(C#N)C(N2CCCC2)=O)ccccc1
SPLASH splash10-0fb9-6948000000-57f47d9497dae5a03978
Source of Spectrum KD-50-13485/SMS7-1n
Wiley ID 1754916