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cyclohexanecarboxylic acid, 1-[(2E)-3-(4-chlorophenyl)-1-oxo-2-propenyl]-, methyl ester
SpectraBase Compound ID 3Xmw9wmOw1P
InChI InChI=1S/C17H19ClO3/c1-21-16(20)17(11-3-2-4-12-17)15(19)10-7-13-5-8-14(18)9-6-13/h5-10H,2-4,11-12H2,1H3/b10-7+
InChIKey ZQSMRZLVBVXMLW-JXMROGBWSA-N
Mol Weight 306.79 g/mol
Molecular Formula C17H19ClO3
Exact Mass 306.102272 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3PR9n1opEKx
Name cyclohexanecarboxylic acid, 1-[(2E)-3-(4-chlorophenyl)-1-oxo-2-propenyl]-, methyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 306.102272169 u
Formula C17H19ClO3
InChI InChI=1S/C17H19ClO3/c1-21-16(20)17(11-3-2-4-12-17)15(19)10-7-13-5-8-14(18)9-6-13/h5-10H,2-4,11-12H2,1H3/b10-7+
InChIKey ZQSMRZLVBVXMLW-JXMROGBWSA-N
Molecular Weight 306.789 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_12392
Solvent DMSO-d6
Source Vendor ID: NMR/10272142; Lab Info: GEI; Lab Number: GEI-she0127