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2-propenoic acid, 3-[5-(2-chlorophenyl)-2-furanyl]-2-cyano-, 1-methylpropyl ester, (2Z)-
SpectraBase Compound ID CrDQ5VauH6y
InChI InChI=1S/C18H16ClNO3/c1-3-12(2)22-18(21)13(11-20)10-14-8-9-17(23-14)15-6-4-5-7-16(15)19/h4-10,12H,3H2,1-2H3/b13-10-
InChIKey BKUQJLLYJOCQIM-RAXLEYEMSA-N
Mol Weight 329.78 g/mol
Molecular Formula C18H16ClNO3
Exact Mass 329.081871 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HQ7QHqIqvxf
Name 2-propenoic acid, 3-[5-(2-chlorophenyl)-2-furanyl]-2-cyano-, 1-methylpropyl ester, (2Z)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 329.081871076 u
Formula C18H16ClNO3
InChI InChI=1S/C18H16ClNO3/c1-3-12(2)22-18(21)13(11-20)10-14-8-9-17(23-14)15-6-4-5-7-16(15)19/h4-10,12H,3H2,1-2H3/b13-10-
InChIKey BKUQJLLYJOCQIM-RAXLEYEMSA-N
Molecular Weight 329.783 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_12593
Solvent DMSO-d6
Source Vendor ID: ZI/10029854; Lab Info: PLU; Lab Number: FCI-483-4625