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1-(Benzyloxy)-4-((E)-3-(4-((E)-2-bromo-5-methoxystyryl)phenoxy)-4-methoxystyryl)-2-(methoxymethoxy)benzene

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

1-(Benzyloxy)-4-((E)-3-(4-((E)-2-bromo-5-methoxystyryl)phenoxy)-4-methoxystyryl)-2-(methoxymethoxy)benzene
SpectraBase Compound ID B4Qvg8ppDkb
InChI InChI=1S/C39H35BrO6/c1-41-27-45-38-23-29(15-22-37(38)44-26-31-7-5-4-6-8-31)9-10-30-14-21-36(43-3)39(24-30)46-33-17-12-28(13-18-33)11-16-32-25-34(42-2)19-20-35(32)40/h4-25H,26-27H2,1-3H3/b10-9+,16-11+
InChIKey UJBKHDSXVOPVGO-AKYRVGECSA-N
Mol Weight 679.6 g/mol
Molecular Formula C39H35BrO6
Exact Mass 678.161702 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4bAHs9V6dFt
Name 1-(Benzyloxy)-4-((E)-3-(4-((E)-2-bromo-5-methoxystyryl)phenoxy)-4-methoxystyryl)-2-(methoxymethoxy)benzene
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 678.161701841 u
Formula C39H35BrO6
InChI InChI=1S/C39H35BrO6/c1-41-27-45-38-23-29(15-22-37(38)44-26-31-7-5-4-6-8-31)9-10-30-14-21-36(43-3)39(24-30)46-33-17-12-28(13-18-33)11-16-32-25-34(42-2)19-20-35(32)40/h4-25H,26-27H2,1-3H3/b10-9+,16-11+
InChIKey UJBKHDSXVOPVGO-AKYRVGECSA-N
Molecular Weight 679.607 g/mol
SMILES C=1(C(=CC(=CC1)\C=C\C=1C=C(C(=CC1)OC)OC=1C=CC(=CC1)\C=C\C=1C(=CC=C(C1)OC)Br)OCOC)OCC=1C=CC=CC1