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(E,Z)-Methyl 3-(4-chloro-3-nitrophenyl)-2-phenoxy-2-propenoate

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

(E,Z)-Methyl 3-(4-chloro-3-nitrophenyl)-2-phenoxy-2-propenoate
SpectraBase Compound ID LKktsu0XR1T
InChI InChI=1S/C16H12ClNO5/c1-22-16(19)15(23-12-5-3-2-4-6-12)10-11-7-8-13(17)14(9-11)18(20)21/h2-10H,1H3/b15-10+
InChIKey PXWICBZPOVPLBU-XNTDXEJSSA-N
Mol Weight 333.73 g/mol
Molecular Formula C16H12ClNO5
Exact Mass 333.0404 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AJCHVFOFlrc
Name (E,Z)-Methyl 3-(4-chloro-3-nitrophenyl)-2-phenoxy-2-propenoate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 333.040400185 u
Formula C16H12ClNO5
InChI InChI=1S/C16H12ClNO5/c1-22-16(19)15(23-12-5-3-2-4-6-12)10-11-7-8-13(17)14(9-11)18(20)21/h2-10H,1H3/b15-10+
InChIKey PXWICBZPOVPLBU-XNTDXEJSSA-N
Molecular Weight 333.727 g/mol
SMILES C=1(N(=O)=O)C(=CC=C(\C=C/(C(=O)OC)OC=2C=CC=CC2)C1)Cl