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3-pyridinecarboxylic acid, 4-(2-chlorophenyl)-1,4,5,6-tetrahydro-2-methyl-6-oxo-, 1-methylethyl ester
SpectraBase Compound ID FhrMSoHb7qD
InChI InChI=1S/C16H18ClNO3/c1-9(2)21-16(20)15-10(3)18-14(19)8-12(15)11-6-4-5-7-13(11)17/h4-7,9,12H,8H2,1-3H3,(H,18,19)
InChIKey NBIPGFOBVANMLK-UHFFFAOYSA-N
Mol Weight 307.78 g/mol
Molecular Formula C16H18ClNO3
Exact Mass 307.097521 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DthQlp9knd2
Name 3-pyridinecarboxylic acid, 4-(2-chlorophenyl)-1,4,5,6-tetrahydro-2-methyl-6-oxo-, 1-methylethyl 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 307.097521141 u
Formula C16H18ClNO3
InChI InChI=1S/C16H18ClNO3/c1-9(2)21-16(20)15-10(3)18-14(19)8-12(15)11-6-4-5-7-13(11)17/h4-7,9,12H,8H2,1-3H3,(H,18,19)
InChIKey NBIPGFOBVANMLK-UHFFFAOYSA-N
Molecular Weight 307.777 g/mol
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_6964
Solvent DMSO-d6
Source Vendor ID: NMR/9321506; Lab Info: SAS; Lab Number: SAS-tst3197
Temperature 23.85 °C