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4-[4-(9-Phenanthrenylmethyl)anilino]-1-butanol

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

4-[4-(9-Phenanthrenylmethyl)anilino]-1-butanol
SpectraBase Compound ID Hqyphb6ivMI
InChI InChI=1S/C25H25NO/c27-16-6-5-15-26-22-13-11-19(12-14-22)17-21-18-20-7-1-2-8-23(20)25-10-4-3-9-24(21)25/h1-4,7-14,18,26-27H,5-6,15-17H2
InChIKey DWIIRDBHTDWEDZ-UHFFFAOYSA-N
Mol Weight 355.48 g/mol
Molecular Formula C25H25NO
Exact Mass 355.193614 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DrxgtdKQH5o
Name 4-[4-(9-Phenanthrenylmethyl)anilino]-1-butanol
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 355.193614428 u
Formula C25H25NO
InChI InChI=1S/C25H25NO/c27-16-6-5-15-26-22-13-11-19(12-14-22)17-21-18-20-7-1-2-8-23(20)25-10-4-3-9-24(21)25/h1-4,7-14,18,26-27H,5-6,15-17H2
InChIKey DWIIRDBHTDWEDZ-UHFFFAOYSA-N
Molecular Weight 355.481 g/mol
SMILES C1(=C2C(C=CC=C2)=C2C(=C1)C=CC=C2)CC=1C=CC(=CC1)NCCCCO