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1,1-bis[ 4'-(Dimethylamino)phenyl]-3-[5'-methyl-2'-(trifluoromethyl)phenyl]-2-propyn-1-ol
SpectraBase Compound ID F2dzrSU1Bmd
InChI InChI=1S/C27H27F3N2O/c1-19-6-15-25(27(28,29)30)20(18-19)16-17-26(33,21-7-11-23(12-8-21)31(2)3)22-9-13-24(14-10-22)32(4)5/h6-15,18,33H,1-5H3
InChIKey NKDSAJQGNYCVFQ-UHFFFAOYSA-N
Mol Weight 452.52 g/mol
Molecular Formula C27H27F3N2O
Exact Mass 452.207548 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4QDSKpiZQxM
Name 1,1-bis[ 4'-(Dimethylamino)phenyl]-3-[5'-methyl-2'-(trifluoromethyl)phenyl]-2-propyn-1-ol
Alternate Name(s) 1,1-bis[4-(dimethylamino)phenyl]-3-[5-methyl-2-(trifluoromethyl)phenyl]-2-propyn-1-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H27F3N2O
InChI InChI=1S/C27H27F3N2O/c1-19-6-15-25(27(28,29)30)20(18-19)16-17-26(33,21-7-11-23(12-8-21)31(2)3)22-9-13-24(14-10-22)32(4)5/h6-15,18,33H,1-5H3
InChIKey NKDSAJQGNYCVFQ-UHFFFAOYSA-N
Molecular Weight 452.521 g/mol
SMILES OC(C#Cc1c(C(F)(F)F)ccc(c1)C)(c1ccc(cc1)N(C)C)c1ccc(cc1)N(C)C
SPLASH splash10-0udr-0100900000-328aeb5383b1ecdaebd5
Source of Spectrum K-127-1631-11
Wiley ID 1388309