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6-Benzoyloxy-1,1-diphenylhex-2-yn-1-ol

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

6-Benzoyloxy-1,1-diphenylhex-2-yn-1-ol
SpectraBase Compound ID ACUMiImkx76
InChI InChI=1S/C25H22O3/c26-24(21-13-5-1-6-14-21)28-20-12-4-11-19-25(27,22-15-7-2-8-16-22)23-17-9-3-10-18-23/h1-3,5-10,13-18,27H,4,12,20H2
InChIKey MPCLWOKVMWHOEV-UHFFFAOYSA-N
Mol Weight 370.45 g/mol
Molecular Formula C25H22O3
Exact Mass 370.156895 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8EbPyVlw76L
Name 6-Benzoyloxy-1,1-diphenylhex-2-yn-1-ol
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 370.156894565 u
Formula C25H22O3
InChI InChI=1S/C25H22O3/c26-24(21-13-5-1-6-14-21)28-20-12-4-11-19-25(27,22-15-7-2-8-16-22)23-17-9-3-10-18-23/h1-3,5-10,13-18,27H,4,12,20H2
InChIKey MPCLWOKVMWHOEV-UHFFFAOYSA-N
Molecular Weight 370.448 g/mol
SMILES C(C1=CC=CC=C1)(C=1C=CC=CC1)(C#CCCCOC(C1=CC=CC=C1)=O)O