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3-(Adamantan-1""""-yl)-4'-(3''-hydroxypropenyl)biphenyl-4-ol

View entire compound with spectra: 1 NMR, and 1 FTIR

3-(Adamantan-1""""-yl)-4'-(3''-hydroxypropenyl)biphenyl-4-ol
SpectraBase Compound ID FbnapEqF5rP
InChI InChI=1S/C25H28O2/c26-9-1-2-17-3-5-21(6-4-17)22-7-8-24(27)23(13-22)25-14-18-10-19(15-25)12-20(11-18)16-25/h1-8,13,18-20,26-27H,9-12,14-16H2/b2-1+/t18-,19+,20-,25-
InChIKey AXTNQHRLMSJADG-IKCLFLBDSA-N
Mol Weight 360.5 g/mol
Molecular Formula C25H28O2
Exact Mass 360.20893 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FslfSM6ZKTy
Name 3-(Adamantan-1""""-yl)-4'-(3''-hydroxypropenyl)biphenyl-4-ol
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 360.208930140 u
Formula C25H28O2
InChI InChI=1S/C25H28O2/c26-9-1-2-17-3-5-21(6-4-17)22-7-8-24(27)23(13-22)25-14-18-10-19(15-25)12-20(11-18)16-25/h1-8,13,18-20,26-27H,9-12,14-16H2/b2-1+/t18-,19+,20-,25-
InChIKey AXTNQHRLMSJADG-IKCLFLBDSA-N
Molecular Weight 360.497 g/mol
SMILES C12(C3=CC(C=4C=CC(\C=C\CO)=CC4)=CC=C3O)C[C@]3(C[C@@](C1)(C[C@@](C2)(C3)[H])[H])[H]