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2-azetidinone, 4-(1,3-benzodioxol-5-yl)-3-(4-chloro-2-methylphenoxy)-1-[3-(trifluoromethyl)phenyl]-
SpectraBase Compound ID 75LG48i2VGY
InChI InChI=1S/C24H17ClF3NO4/c1-13-9-16(25)6-8-18(13)33-22-21(14-5-7-19-20(10-14)32-12-31-19)29(23(22)30)17-4-2-3-15(11-17)24(26,27)28/h2-11,21-22H,12H2,1H3
InChIKey VBCNPYHIAZLNCZ-UHFFFAOYSA-N
Mol Weight 475.85 g/mol
Molecular Formula C24H17ClF3NO4
Exact Mass 475.07982 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BhXF0aLh4kR
Name 2-azetidinone, 4-(1,3-benzodioxol-5-yl)-3-(4-chloro-2-methylphenoxy)-1-[3-(trifluoromethyl)phenyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 475.079820216 u
Formula C24H17ClF3NO4
InChI InChI=1S/C24H17ClF3NO4/c1-13-9-16(25)6-8-18(13)33-22-21(14-5-7-19-20(10-14)32-12-31-19)29(23(22)30)17-4-2-3-15(11-17)24(26,27)28/h2-11,21-22H,12H2,1H3
InChIKey VBCNPYHIAZLNCZ-UHFFFAOYSA-N
Molecular Weight 475.851 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17945
Solvent DMSO-d6
Source Vendor ID: NMR/11270791; Lab Info: SAS; Lab Number: SAS-tst5132