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2H-pyran-2,4(3H)-dione, 6-(4-bromophenyl)-3-[2-(4-fluorophenyl)-2-oxoethyl]dihydro-3,5,5-trimethyl-
SpectraBase Compound ID Gf6UTdmhNIn
InChI InChI=1S/C22H20BrFO4/c1-21(2)18(14-4-8-15(23)9-5-14)28-20(27)22(3,19(21)26)12-17(25)13-6-10-16(24)11-7-13/h4-11,18H,12H2,1-3H3
InChIKey UHZJZPLJWGIJRO-UHFFFAOYSA-N
Mol Weight 447.3 g/mol
Molecular Formula C22H20BrFO4
Exact Mass 446.0529 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID L5WW9tYVSsW
Name 2H-pyran-2,4(3H)-dione, 6-(4-bromophenyl)-3-[2-(4-fluorophenyl)-2-oxoethyl]dihydro-3,5,5-trimethyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 446.052900283 u
Formula C22H20BrFO4
InChI InChI=1S/C22H20BrFO4/c1-21(2)18(14-4-8-15(23)9-5-14)28-20(27)22(3,19(21)26)12-17(25)13-6-10-16(24)11-7-13/h4-11,18H,12H2,1-3H3
InChIKey UHZJZPLJWGIJRO-UHFFFAOYSA-N
Molecular Weight 447.300 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_18042
Solvent DMSO-d6
Source Vendor ID: NMR/11222729; Lab Info: GEI; Lab Number: GEI-SHE0178