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4,4-Difluoro-3,5-bis(styryl)-8-(4-tolyl)-4-bora-3a,4a-diaza-s-indacene
SpectraBase Compound ID ETflzs83Qpe
InChI InChI=1S/C32H25BF2N2/c1-24-12-16-27(17-13-24)32-30-22-20-28(18-14-25-8-4-2-5-9-25)36(30)33(34,35)37-29(21-23-31(32)37)19-15-26-10-6-3-7-11-26/h2-23H,1H3/b18-14+,19-15+
InChIKey RAWQXHBOWIMKQT-JSAVKQRWSA-N
Mol Weight 486.4 g/mol
Molecular Formula C32H25BF2N2
Exact Mass 486.207885 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 42QDERSOGh4
Name 4,4-Difluoro-3,5-bis(styryl)-8-(4-tolyl)-4-bora-3a,4a-diaza-s-indacene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H25BF2N2
InChI InChI=1S/C32H25BF2N2/c1-24-12-16-27(17-13-24)32-30-22-20-28(18-14-25-8-4-2-5-9-25)36(30)33(34,35)37-29(21-23-31(32)37)19-15-26-10-6-3-7-11-26/h2-23H,1H3/b18-14+,19-15+
InChIKey RAWQXHBOWIMKQT-JSAVKQRWSA-N
Molecular Weight 486.373 g/mol
SMILES C1=2[N]([B]([n]3c(C2c2ccc(cc2)C)ccc3\C=C\c2ccccc2)(F)F)=C(C=C1)\C=C\c1ccccc1
SPLASH splash10-000i-0001900000-d2f7b56ef9a196f7f6a4
Source of Spectrum K1-0-4662-3
Synonyms 2,2-Difluoro-8-(4-methylphenyl)-4,12-bis[(E)-2-phenylethenyl]-1,3-diaza-2-boratricyclo[7.3.0.0(3,7)]dodeca-1(12),4,6,8,10-pentaene
Wiley ID 1589675