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Trans-2-[(4'-N-carbazolyl)styryl]-5-dimesitylborylthiophene

View entire compound with spectra: 1 NMR, and 1 MS (GC)

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

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5xGCoTieudx
Name Trans-2-[(4'-N-carbazolyl)styryl]-5-dimesitylborylthiophene
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 599.281801572 u
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 C=1(B(C2=C(C=C(C=C2C)C)C)C2=C(C=C(C=C2C)C)C)SC(\C=C\C=2C=CC(N3C4=C(C=CC=C4)C4=C3C=CC=C4)=CC2)=CC1