For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

2'-(N-Butyl)oxy-3,4,4',5-tetramethoxychalcone (isomer 1)

View entire compound with spectra: 1 NMR, and 1 FTIR

2'-(N-Butyl)oxy-3,4,4',5-tetramethoxychalcone (isomer 1)
SpectraBase Compound ID I5R0qHB5FZR
InChI InChI=1S/C23H28O6/c1-6-7-12-29-20-15-17(25-2)9-10-18(20)19(24)11-8-16-13-21(26-3)23(28-5)22(14-16)27-4/h8-11,13-15H,6-7,12H2,1-5H3/b11-8+
InChIKey SHWMEGCYIUXGDT-DHZHZOJOSA-N
Mol Weight 400.47 g/mol
Molecular Formula C23H28O6
Exact Mass 400.188589 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 727MuWmZtvY
Name 2'-(N-Butyl)oxy-3,4,4',5-tetramethoxychalcone (isomer 1)
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 400.188588616 u
Formula C23H28O6
InChI InChI=1S/C23H28O6/c1-6-7-12-29-20-15-17(25-2)9-10-18(20)19(24)11-8-16-13-21(26-3)23(28-5)22(14-16)27-4/h8-11,13-15H,6-7,12H2,1-5H3/b11-8+
InChIKey SHWMEGCYIUXGDT-DHZHZOJOSA-N
Molecular Weight 400.471 g/mol
SMILES C1(=C(C=C(C=C1)OC)OCCCC)C(\C=C\C=1C=C(OC)C(OC)=C(OC)C1)=O