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2-(Trifluoromethy)-1H-dibenzo[eg]indole
SpectraBase Compound ID 5FZcErjafeA
InChI InChI=1S/C17H10F3N/c18-17(19,20)15-9-14-12-7-2-1-5-10(12)11-6-3-4-8-13(11)16(14)21-15/h1-9,21H
InChIKey DPPWBGXMOMHRDS-UHFFFAOYSA-N
Mol Weight 285.27 g/mol
Molecular Formula C17H10F3N
Exact Mass 285.076534 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HcqKX9GAjRT
Name 2-(Trifluoromethy)-1H-dibenzo[eg]indole
Comments Computed using HOSE algorithm
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Exact Mass 285.076533815 u
Formula C17H10F3N
InChI InChI=1S/C17H10F3N/c18-17(19,20)15-9-14-12-7-2-1-5-10(12)11-6-3-4-8-13(11)16(14)21-15/h1-9,21H
InChIKey DPPWBGXMOMHRDS-UHFFFAOYSA-N
Molecular Weight 285.269 g/mol
SMILES C=12C(C=C(N2)C(F)(F)F)=C2C=CC=CC2=C2C1C=CC=C2