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o-Bromophenylcarbonylmethylidenetriphenylphosphorane

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

o-Bromophenylcarbonylmethylidenetriphenylphosphorane
SpectraBase Compound ID IrEkcBvbAsf
InChI InChI=1S/C26H20BrOP/c27-25-19-11-10-18-24(25)26(28)20-29(21-12-4-1-5-13-21,22-14-6-2-7-15-22)23-16-8-3-9-17-23/h1-20H
InChIKey OUWVEFDSPFDKDZ-UHFFFAOYSA-N
Mol Weight 459.32 g/mol
Molecular Formula C26H20BrOP
Exact Mass 458.043515 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7eJ35st1sba
Name o-Bromophenylcarbonylmethylidenetriphenylphosphorane
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 458.043515261 u
Formula C26H20BrOP
InChI InChI=1S/C26H20BrOP/c27-25-19-11-10-18-24(25)26(28)20-29(21-12-4-1-5-13-21,22-14-6-2-7-15-22)23-16-8-3-9-17-23/h1-20H
InChIKey OUWVEFDSPFDKDZ-UHFFFAOYSA-N
Molecular Weight 459.323 g/mol
SMILES C(=P(C1=CC=CC=C1)(C=1C=CC=CC1)C=1C=CC=CC1)C(C=1C(Br)=CC=CC1)=O