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2-(1-Phenanthryl)benzaldehyde
SpectraBase Compound ID ISF4Xe3oxNz
InChI InChI=1S/C21H14O/c22-14-16-7-2-4-9-18(16)20-11-5-10-19-17-8-3-1-6-15(17)12-13-21(19)20/h1-14H
InChIKey GKDSGWBTXIPKHA-UHFFFAOYSA-N
Mol Weight 282.34 g/mol
Molecular Formula C21H14O
Exact Mass 282.104465 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JyzxbgWsIMx
Name 2-(1-Phenanthryl)benzaldehyde
Comments Computed using HOSE algorithm
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Exact Mass 282.104465070 u
Formula C21H14O
InChI InChI=1S/C21H14O/c22-14-16-7-2-4-9-18(16)20-11-5-10-19-17-8-3-1-6-15(17)12-13-21(19)20/h1-14H
InChIKey GKDSGWBTXIPKHA-UHFFFAOYSA-N
SMILES C12=C(C=3C(C=O)=CC=CC3)C=CC=C1C1=CC=CC=C1C=C2