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1-Benzyl-4-(4'-chlorooctafluorobutylmethyl)-3-(E)-(1'-iodobutylidene)-2(3H)-dihydropyrrolidone
SpectraBase Compound ID AvyLOXuS5w1
InChI InChI=1S/C20H19ClF8INO/c1-2-6-14(30)15-13(11-31(16(15)32)10-12-7-4-3-5-8-12)9-17(22,23)18(24,25)19(26,27)20(21,28)29/h3-5,7-8,13H,2,6,9-11H2,1H3/b15-14+
InChIKey YVVKUAMQCFNDPY-CCEZHUSRSA-N
Mol Weight 603.72 g/mol
Molecular Formula C20H19ClF8INO
Exact Mass 603.007212 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8duJVweWGDT
Name 1-Benzyl-4-(4'-chlorooctafluorobutylmethyl)-3-(E)-(1'-iodobutylidene)-2(3H)-dihydropyrrolidone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H19ClF8INO
InChI InChI=1S/C20H19ClF8INO/c1-2-6-14(30)15-13(11-31(16(15)32)10-12-7-4-3-5-8-12)9-17(22,23)18(24,25)19(26,27)20(21,28)29/h3-5,7-8,13H,2,6,9-11H2,1H3/b15-14+
InChIKey YVVKUAMQCFNDPY-CCEZHUSRSA-N
Molecular Weight 603.723 g/mol
SMILES C(C(C(F)(F)Cl)(F)F)(C(CC1\C(C(=O)N(C1)Cc1ccccc1)=C\(I)CCC)(F)F)(F)F
SPLASH splash10-004l-7000900000-d5c137f216e02779297d
Source of Spectrum F-51-2656-17
Wiley ID 791168