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(R)-3-Methyl-4-methylene-6-((S)-pentafluorophenyl-pentafluorophenylamino-methyl)-cyclohex-2-enone
SpectraBase Compound ID DQf4Yewqs5r
InChI InChI=1S/C21H11F10NO/c1-5-3-7(8(33)4-6(5)2)20(9-10(22)12(24)14(26)13(25)11(9)23)32-21-18(30)16(28)15(27)17(29)19(21)31/h4,7,20,32H,1,3H2,2H3/t7-,20-/m0/s1
InChIKey YUUSYYCQMKLFBH-JKNYTWMOSA-N
Mol Weight 483.31 g/mol
Molecular Formula C21H11F10NO
Exact Mass 483.068096 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3DDUGcJtbMd
Name (R)-3-Methyl-4-methylene-6-((S)-pentafluorophenyl-pentafluorophenylamino-methyl)-cyclohex-2-enone
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H11F10NO
InChI InChI=1S/C21H11F10NO/c1-5-3-7(8(33)4-6(5)2)20(9-10(22)12(24)14(26)13(25)11(9)23)32-21-18(30)16(28)15(27)17(29)19(21)31/h4,7,20,32H,1,3H2,2H3/t7-,20-/m0/s1
InChIKey YUUSYYCQMKLFBH-JKNYTWMOSA-N
Molecular Weight 483.309 g/mol
SMILES N(c1c(c(F)c(c(c1F)F)F)F)[C@](c1c(c(F)c(c(c1F)F)F)F)([C@@]1(C(C=C(C(C1)=C)C)=O)[H])[H]
SPLASH splash10-074i-0903000000-f40fc25a754bb0584138
Source of Spectrum KC-61-3850-12
Synonyms (6R)-3-methyl-4-methylene-6-[(S)-(2,3,4,5,6-pentafluoroanilino)(2,3,4,5,6-pentafluorophenyl)methyl]-2-cyclohexen-1-one 3-Methyl-4-methylene-6-(pentafluorophenylpentafluorophenylaminomethyl)cyclohex-2-enone
Wiley ID 1628647