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2-Chloro-6-fluoro-4-phenylethynyl-3-(2,2,5,5-tetramethyl-[1,2,5]azadisilolidin-1-yl)-benzonitrile

View entire compound with spectra: 1 MS (GC)

2-Chloro-6-fluoro-4-phenylethynyl-3-(2,2,5,5-tetramethyl-[1,2,5]azadisilolidin-1-yl)-benzonitrile
SpectraBase Compound ID KNsE6T1725x
InChI InChI=1S/C21H22ClFN2Si2/c1-26(2)12-13-27(3,4)25(26)21-17(11-10-16-8-6-5-7-9-16)14-19(23)18(15-24)20(21)22/h5-9,14H,12-13H2,1-4H3
InChIKey TVYPVWQMYWXQTF-UHFFFAOYSA-N
Mol Weight 413.04 g/mol
Molecular Formula C21H22ClFN2Si2
Exact Mass 412.099408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Rnl3ZCBYTM
Name 2-Chloro-6-fluoro-4-phenylethynyl-3-(2,2,5,5-tetramethyl-[1,2,5]azadisilolidin-1-yl)-benzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22ClFN2Si2
InChI InChI=1S/C21H22ClFN2Si2/c1-26(2)12-13-27(3,4)25(26)21-17(11-10-16-8-6-5-7-9-16)14-19(23)18(15-24)20(21)22/h5-9,14H,12-13H2,1-4H3
InChIKey TVYPVWQMYWXQTF-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol7025872
Molecular Weight 413.042 g/mol
SMILES C[Si]1(C)CC[Si](C)(C)N1c1c(C#Cc2ccccc2)cc(c(C#N)c1Cl)F
SPLASH splash10-00di-0092000000-ab7fc45ea86b7fc865f2
Source of Spectrum A1-10-113/SM39-7c
Synonyms 2-Chloro-6-fluoro-4-(phenylethynyl)-3-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)benzonitrile
Wiley ID 1758940