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3-[4-(2,4-dimethoxy-3-methylphenyl)butyl]-5-methoxy-2-methyl-1H-indene; butane-2,3-dione
SpectraBase Compound ID 7XK7HLqfjVX
InChI InChI=1S/C22H28N2O3.C2H2O4/c1-14-21(26-4)9-6-16(22(14)27-5)13-23-11-10-18-15(2)24-20-8-7-17(25-3)12-19(18)20;3-1(4)2(5)6/h6-9,12,23-24H,10-11,13H2,1-5H3;(H,3,4)(H,5,6)
InChIKey PTPMJBNXWCYVSY-UHFFFAOYSA-N
Mol Weight 458.51 g/mol
Molecular Formula C24H30N2O7
Exact Mass 458.205301 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HO6DqMihm0
Name 3-[4-(2,4-dimethoxy-3-methylphenyl)butyl]-5-methoxy-2-methyl-1H-indene; butane-2,3-dione
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 458.205301307 u
Formula C24H30N2O7
InChI InChI=1S/C22H28N2O3.C2H2O4/c1-14-21(26-4)9-6-16(22(14)27-5)13-23-11-10-18-15(2)24-20-8-7-17(25-3)12-19(18)20;3-1(4)2(5)6/h6-9,12,23-24H,10-11,13H2,1-5H3;(H,3,4)(H,5,6)
InChIKey PTPMJBNXWCYVSY-UHFFFAOYSA-N
Molecular Weight 458.511 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17202
Solvent DMSO-d6
Source Vendor ID: NMR/11270455; Lab Info: GRI; Lab Number: GRI-0000005