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N-{.beta.-[3',4'-Dimethoxy-6'-(1''-oxobutyl)phenyl]ethyl}-3,4-dimethoxybenzamide
SpectraBase Compound ID Im7gIirUTSP
InChI InChI=1S/C23H29NO6/c1-6-7-18(25)17-14-22(30-5)21(29-4)12-15(17)10-11-24-23(26)16-8-9-19(27-2)20(13-16)28-3/h8-9,12-14H,6-7,10-11H2,1-5H3,(H,24,26)
InChIKey PNNWAWULSYDERZ-UHFFFAOYSA-N
Mol Weight 415.49 g/mol
Molecular Formula C23H29NO6
Exact Mass 415.199488 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7zSDvk0WJLI
Name N-{.beta.-[3',4'-Dimethoxy-6'-(1''-oxobutyl)phenyl]ethyl}-3,4-dimethoxybenzamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 415.199487652 u
Formula C23H29NO6
InChI InChI=1S/C23H29NO6/c1-6-7-18(25)17-14-22(30-5)21(29-4)12-15(17)10-11-24-23(26)16-8-9-19(27-2)20(13-16)28-3/h8-9,12-14H,6-7,10-11H2,1-5H3,(H,24,26)
InChIKey PNNWAWULSYDERZ-UHFFFAOYSA-N
Molecular Weight 415.486 g/mol
SMILES C=1(C=C(OC)C(=CC1CCNC(C=1C=C(OC)C(=CC1)OC)=O)OC)C(=O)CCC