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3-Ethoxy-5-isopropyl-N,N-dimethyl-1-[4-(trifluoromethyl)phenyl]-2-[2-[4-(trifluoromethyl)phenyl]ethynyl]cyclopenta-2,4-dien-1-amine
SpectraBase Compound ID F7NpG9M7C2E
InChI InChI=1S/C28H27F6NO/c1-6-36-25-17-24(18(2)3)26(35(4)5,20-12-14-22(15-13-20)28(32,33)34)23(25)16-9-19-7-10-21(11-8-19)27(29,30)31/h7-8,10-15,17-18H,6H2,1-5H3
InChIKey XIUSKOMARMHBJR-UHFFFAOYSA-N
Mol Weight 507.52 g/mol
Molecular Formula C28H27F6NO
Exact Mass 507.199683 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1pdWsMyc18v
Name 3-Ethoxy-5-isopropyl-N,N-dimethyl-1-[4-(trifluoromethyl)phenyl]-2-[2-[4-(trifluoromethyl)phenyl]ethynyl]cyclopenta-2,4-dien-1-amine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H27F6NO
InChI InChI=1S/C28H27F6NO/c1-6-36-25-17-24(18(2)3)26(35(4)5,20-12-14-22(15-13-20)28(32,33)34)23(25)16-9-19-7-10-21(11-8-19)27(29,30)31/h7-8,10-15,17-18H,6H2,1-5H3
InChIKey XIUSKOMARMHBJR-UHFFFAOYSA-N
Molecular Weight 507.520 g/mol
SMILES C=1(C(C(C(C)C)=CC1OCC)(c1ccc(C(F)(F)F)cc1)N(C)C)C#Cc1ccc(C(F)(F)F)cc1
SPLASH splash10-0bt9-0113960000-4bc59d71d2430bcb3093
Source of Spectrum K1-2004-740-17
Synonyms 3-Ethoxy-N,N-dimethyl-5-propan-2-yl-1-[4-(trifluoromethyl)phenyl]-2-[2-[4-(trifluoromethyl)phenyl]ethynyl]-1-cyclopenta-2,4-dienamine 3-Ethoxy-N,N-dimethyl-5-propan-2-yl-1-[4-(trifluoromethyl)phenyl]-2-[2-[4-(trifluoromethyl)phenyl]ethynyl]cyclopenta-2,4-dien-1-amine [3-ethoxy-5-isopropyl-1-[4-(trifluoromethyl)phenyl]-2-[2-[4-(trifluoromethyl)phenyl]ethynyl]cyclopenta-2,4-dien-1-yl]-dimethyl-amine
Wiley ID 1560371