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1,3-cyclohexanedione, 5-(3-chlorophenyl)-2-[[(3-hydroxypropyl)amino]methylene]-
SpectraBase Compound ID 7WEKSAfmHfe
InChI InChI=1S/C16H18ClNO3/c17-13-4-1-3-11(7-13)12-8-15(20)14(16(21)9-12)10-18-5-2-6-19/h1,3-4,7,10,12,18-19H,2,5-6,8-9H2/b14-10-
InChIKey WXIYGDJKIWWZCA-UVTDQMKNSA-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 CyhGqOaBFvh
Name 1,3-cyclohexanedione, 5-(3-chlorophenyl)-2-[[(3-hydroxypropyl)amino]methylene]-
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/c17-13-4-1-3-11(7-13)12-8-15(20)14(16(21)9-12)10-18-5-2-6-19/h1,3-4,7,10,12,18-19H,2,5-6,8-9H2/b14-10-
InChIKey WXIYGDJKIWWZCA-UVTDQMKNSA-N
Molecular Weight 307.777 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_16423
Solvent DMSO-d6
Source Vendor ID: NMR/11241975; Lab Info: PRE; Lab Number: PRE-L000016