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trans-2-[(4'-N-Carbazolyl)styryl]-5-dimesitylborylthiophene
SpectraBase Compound ID DNRgWetYv1b
InChI InChI=1S/C42H38BNS/c1-27-23-29(3)41(30(4)24-27)43(42-31(5)25-28(2)26-32(42)6)40-22-21-35(45-40)20-17-33-15-18-34(19-16-33)44-38-13-9-7-11-36(38)37-12-8-10-14-39(37)44/h7-26H,1-6H3/b20-17+
InChIKey JEFUOCBBXDTTMN-LVZFUZTISA-N
Mol Weight 599.6 g/mol
Molecular Formula C42H38BNS
Exact Mass 599.281802 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EyHMt9XwkJ8
Name trans-2-[(4'-N-Carbazolyl)styryl]-5-dimesitylborylthiophene
Comments Less than 3 mono-isotopic peaks
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Formula C42H38BNS
InChI InChI=1S/C42H38BNS/c1-27-23-29(3)41(30(4)24-27)43(42-31(5)25-28(2)26-32(42)6)40-22-21-35(45-40)20-17-33-15-18-34(19-16-33)44-38-13-9-7-11-36(38)37-12-8-10-14-39(37)44/h7-26H,1-6H3/b20-17+
InChIKey JEFUOCBBXDTTMN-LVZFUZTISA-N
Molecular Weight 599.643 g/mol
SMILES c1(B(c2c(cc(cc2C)C)C)c2c(cc(cc2C)C)C)sc(\C=C\c2ccc(-[n]3c4c(cccc4)c4c3cccc4)cc2)cc1
SPLASH splash10-0002-0000390000-4a15bd68027e7d5912e5
Source of Spectrum QF-9-5082-8
Wiley ID 1558892