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1-(2-Allyl-4-fluorophenyl)pyrrolidine-2,5-dione

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

1-(2-Allyl-4-fluorophenyl)pyrrolidine-2,5-dione
SpectraBase Compound ID 5swaUMXHpCC
InChI InChI=1S/C13H12FNO2/c1-2-3-9-8-10(14)4-5-11(9)15-12(16)6-7-13(15)17/h2,4-5,8H,1,3,6-7H2
InChIKey ZYIGYHCMIQSIMV-UHFFFAOYSA-N
Mol Weight 233.24 g/mol
Molecular Formula C13H12FNO2
Exact Mass 233.085207 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID B7CeUZvJyVj
Name 1-(2-Allyl-4-fluorophenyl)pyrrolidine-2,5-dione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 233.085206791 u
Formula C13H12FNO2
InChI InChI=1S/C13H12FNO2/c1-2-3-9-8-10(14)4-5-11(9)15-12(16)6-7-13(15)17/h2,4-5,8H,1,3,6-7H2
InChIKey ZYIGYHCMIQSIMV-UHFFFAOYSA-N
Molecular Weight 233.242 g/mol
SMILES C=1(C=C(C(N2C(CCC2=O)=O)=CC1)CC=C)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.826709