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1-Benzyl-4-(2'-chlorotetrafluoroethylmethyl)-3-(E)-(1'-iodobutylidene)-2(3H)-dihydropyrrolidone
SpectraBase Compound ID 25ibsQwQudM
InChI InChI=1S/C18H19ClF4INO/c1-2-6-14(24)15-13(9-17(20,21)18(19,22)23)11-25(16(15)26)10-12-7-4-3-5-8-12/h3-5,7-8,13H,2,6,9-11H2,1H3/b15-14+
InChIKey ZRPWKIARHHSDEB-CCEZHUSRSA-N
Mol Weight 503.71 g/mol
Molecular Formula C18H19ClF4INO
Exact Mass 503.0136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9ijUhXPkoQn
Name 1-Benzyl-4-(2'-chlorotetrafluoroethylmethyl)-3-(E)-(1'-iodobutylidene)-2(3H)-dihydropyrrolidone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H19ClF4INO
InChI InChI=1S/C18H19ClF4INO/c1-2-6-14(24)15-13(9-17(20,21)18(19,22)23)11-25(16(15)26)10-12-7-4-3-5-8-12/h3-5,7-8,13H,2,6,9-11H2,1H3/b15-14+
InChIKey ZRPWKIARHHSDEB-CCEZHUSRSA-N
Molecular Weight 503.707 g/mol
SMILES C1(\C(C(CN1Cc1ccccc1)CC(C(Cl)(F)F)(F)F)=C/(I)CCC)=O
SPLASH splash10-004l-8009000000-9ece29587ddc41f50152
Source of Spectrum F-51-2655-17
Wiley ID 791169