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1,3-Di-tert-butyl-2-(pentafluoro-phenyl)-4,4-diphenyl-1,3,2-diazaboretidine
SpectraBase Compound ID EBrjsgfeBzE
InChI InChI=1S/C27H28BF5N2/c1-25(2,3)34-27(17-13-9-7-10-14-17,18-15-11-8-12-16-18)35(26(4,5)6)28(34)19-20(29)22(31)24(33)23(32)21(19)30/h7-16H,1-6H3
InChIKey ZFAGJOBMAAMKOF-UHFFFAOYSA-N
Mol Weight 486.3 g/mol
Molecular Formula C27H28BF5N2
Exact Mass 486.22657 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ligq5pW5ww9
Name 1,3-Ditert-butyl-2-(2,3,4,5,6-pentafluorophenyl)-4,4-diphenyl-1,3,2-diazaboretidine
CAS Registry Number 72886-63-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H28BF5N2
InChI InChI=1S/C27H28BF5N2/c1-25(2,3)34-27(17-13-9-7-10-14-17,18-15-11-8-12-16-18)35(26(4,5)6)28(34)19-20(29)22(31)24(33)23(32)21(19)30/h7-16H,1-6H3
InChIKey ZFAGJOBMAAMKOF-UHFFFAOYSA-N
Molecular Weight 486.337 g/mol
SMILES C(N1B(N(C1(c1ccccc1)c1ccccc1)C(C)(C)C)c1c(c(F)c(c(c1F)F)F)F)(C)(C)C
SPLASH splash10-014i-0000900000-a35621e3319091805f5a
Source of Spectrum K-112-3826-0
Synonyms 1,3-Ditert-butyl-2-[2,3,4,5,6-pentakis(fluoranyl)phenyl]-4,4-diphenyl-1,3,2-diazaboretidine
Wiley ID 1396482