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trans-4-[2-(10b,10c-Dimethyl-10b,10c-dihydropyrenyl)benzophenone

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

trans-4-[2-(10b,10c-Dimethyl-10b,10c-dihydropyrenyl)benzophenone
SpectraBase Compound ID 3b65O9rTrpc
InChI InChI=1S/C31H24O/c1-30-25-9-6-10-26(30)16-18-28-20-24(19-27(17-15-25)31(28,30)2)21-11-13-23(14-12-21)29(32)22-7-4-3-5-8-22/h3-20H,1-2H3
InChIKey QGYCVYGHDFFVAZ-UHFFFAOYSA-N
Mol Weight 412.53 g/mol
Molecular Formula C31H24O
Exact Mass 412.182715 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GcRzgbYuF9f
Name Trans-4-[2-(10B,10C-dimethyl-10B,10C-dihydropyrenyl)benzophenone
Comments Computed using HOSE algorithm
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Exact Mass 412.182715392 u
Formula C31H24O
InChI InChI=1S/C31H24O/c1-30-25-9-6-10-26(30)16-18-28-20-24(19-27(17-15-25)31(28,30)2)21-11-13-23(14-12-21)29(32)22-7-4-3-5-8-22/h3-20H,1-2H3
InChIKey QGYCVYGHDFFVAZ-UHFFFAOYSA-N
Molecular Weight 412.532 g/mol
SMILES C12(C3=CC(=CC2=CC=C2C1(C(C=C3)=CC=C2)C)C=1C=CC(C(=O)C2=CC=CC=C2)=CC1)C