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1-Benzyl-3-chloro-4-hexyl-1H-pyrrole-2,5-dione

View entire compound with spectra: 1 MS (GC)

1-Benzyl-3-chloro-4-hexyl-1H-pyrrole-2,5-dione
SpectraBase Compound ID 3GaVn3UiZ3l
InChI InChI=1S/C17H20ClNO2/c1-2-3-4-8-11-14-15(18)17(21)19(16(14)20)12-13-9-6-5-7-10-13/h5-7,9-10H,2-4,8,11-12H2,1H3
InChIKey BAUGKCLDAQXNNW-UHFFFAOYSA-N
Mol Weight 305.81 g/mol
Molecular Formula C17H20ClNO2
Exact Mass 305.118257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JeDWBy4Rtqu
Name 1-Benzyl-3-chloro-4-hexyl-1H-pyrrole-2,5-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20ClNO2
InChI InChI=1S/C17H20ClNO2/c1-2-3-4-8-11-14-15(18)17(21)19(16(14)20)12-13-9-6-5-7-10-13/h5-7,9-10H,2-4,8,11-12H2,1H3
InChIKey BAUGKCLDAQXNNW-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol900063p
Molecular Weight 305.805 g/mol
SMILES C=1(C(=O)N(Cc2ccccc2)C(=O)C1Cl)CCCCCC
SPLASH splash10-0a4l-7049000000-68f05511c4ebe53b7d7b
Source of Spectrum A1-11-1285/SMS6-11
Wiley ID 1756644