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1-(2-Chloro-1,2-diphenylethenyl)-4-methoxybenzene (isomer 1)
SpectraBase Compound ID E7YJcv1Ajfw
InChI InChI=1S/C21H17ClO/c1-23-19-14-12-17(13-15-19)20(16-8-4-2-5-9-16)21(22)18-10-6-3-7-11-18/h2-15H,1H3/b21-20+
InChIKey CRZZNHLZXLMEPA-QZQOTICOSA-N
Mol Weight 320.82 g/mol
Molecular Formula C21H17ClO
Exact Mass 320.096793 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ARusF1TxtjG
Name 1-(2-Chloro-1,2-diphenylethenyl)-4-methoxybenzene (isomer 1)
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 320.096792866 u
Formula C21H17ClO
InChI InChI=1S/C21H17ClO/c1-23-19-14-12-17(13-15-19)20(16-8-4-2-5-9-16)21(22)18-10-6-3-7-11-18/h2-15H,1H3/b21-20+
InChIKey CRZZNHLZXLMEPA-QZQOTICOSA-N
Molecular Weight 320.819 g/mol
SMILES C1(\C(=C/(Cl)C2=CC=CC=C2)C2=CC=CC=C2)=CC=C(C=C1)OC