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5-Phenyl-8,9,10,11,12,13-hexahydro-7H-cyclohepta[a]phenanthrene

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5-Phenyl-8,9,10,11,12,13-hexahydro-7H-cyclohepta[a]phenanthrene
SpectraBase Compound ID 5rYDHRcZrIK
InChI InChI=1S/C25H24/c1-3-9-18(10-4-1)24-17-20-12-5-2-6-13-21(20)23-16-15-19-11-7-8-14-22(19)25(23)24/h1,3-4,7-11,14,17H,2,5-6,12-13,15-16H2
InChIKey JLYMMWBGJUCPLH-UHFFFAOYSA-N
Mol Weight 324.47 g/mol
Molecular Formula C25H24
Exact Mass 324.187801 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9Q6JpLzFyig
Name 5-Phenyl-8,9,10,11,12,13-hexahydro-7H-cyclohepta[A]phenanthrene
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 324.187800773 u
Formula C25H24
InChI InChI=1S/C25H24/c1-3-9-18(10-4-1)24-17-20-12-5-2-6-13-21(20)23-16-15-19-11-7-8-14-22(19)25(23)24/h1,3-4,7-11,14,17H,2,5-6,12-13,15-16H2
InChIKey JLYMMWBGJUCPLH-UHFFFAOYSA-N
Molecular Weight 324.467 g/mol
SMILES C1=2C(=C3CCCCCC3=CC2C=2C=CC=CC2)CCC2=C1C=CC=C2