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2H-indol-2-one, 3-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]-4-bromo-1,3-dihydro-3-hydroxy-5-methyl-
SpectraBase Compound ID 3JgqFcagkv7
InChI InChI=1S/C18H14BrNO5/c1-9-2-4-11-15(16(9)19)18(23,17(22)20-11)7-12(21)10-3-5-13-14(6-10)25-8-24-13/h2-6,23H,7-8H2,1H3,(H,20,22)
InChIKey SJXSNMXBXJIRLV-UHFFFAOYSA-N
Mol Weight 404.22 g/mol
Molecular Formula C18H14BrNO5
Exact Mass 403.005536 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1csY1ENqlG4
Name 2H-indol-2-one, 3-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]-4-bromo-1,3-dihydro-3-hydroxy-5-methyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 403.005535550 u
Formula C18H14BrNO5
InChI InChI=1S/C18H14BrNO5/c1-9-2-4-11-15(16(9)19)18(23,17(22)20-11)7-12(21)10-3-5-13-14(6-10)25-8-24-13/h2-6,23H,7-8H2,1H3,(H,20,22)
InChIKey SJXSNMXBXJIRLV-UHFFFAOYSA-N
Molecular Weight 404.216 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17614
Solvent DMSO-d6
Source Vendor ID: NMR/11230558; Lab Info: LP; Lab Number: LP-0105009