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2-Amino-4-(4-fluorophenyl)-4H-benzo[H]chromene-3-carbonitrile, tms derivative

View entire compound with spectra: 1 NMR

2-Amino-4-(4-fluorophenyl)-4H-benzo[H]chromene-3-carbonitrile, tms derivative
SpectraBase Compound ID HXqQJ4V1tRM
InChI InChI=1S/C23H21FN2OSi/c1-28(2,3)26-23-20(14-25)21(16-8-11-17(24)12-9-16)19-13-10-15-6-4-5-7-18(15)22(19)27-23/h4-13,21,26H,1-3H3
InChIKey BHNILHVCBABYKQ-UHFFFAOYSA-N
Mol Weight 388.52 g/mol
Molecular Formula C23H21FN2OSi
Exact Mass 388.140718 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5uZualS33ZK
Name 2-Amino-4-(4-fluorophenyl)-4H-benzo[H]chromene-3-carbonitrile, tms derivative
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 388.140718001 u
Formula C23H21FN2OSi
InChI InChI=1S/C23H21FN2OSi/c1-28(2,3)26-23-20(14-25)21(16-8-11-17(24)12-9-16)19-13-10-15-6-4-5-7-18(15)22(19)27-23/h4-13,21,26H,1-3H3
InChIKey BHNILHVCBABYKQ-UHFFFAOYSA-N
Molecular Weight 388.517 g/mol
SMILES C1(F)=CC=C(C=C1)C1C2=C(C3=C(C=C2)C=CC=C3)OC(=C1C#N)N[Si](C)(C)C