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2,5-Dimethoxy-4-{4-(octadecyloxy)methyl}-2,5-dioxocyclohexa-3,6-dienylbenzaldehyde
SpectraBase Compound ID CkzfDBsOxaq
InChI InChI=1S/C34H50O6/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-40-26-28-21-32(37)29(23-31(28)36)30-24-33(38-2)27(25-35)22-34(30)39-3/h21-25H,4-20,26H2,1-3H3
InChIKey PBQNRDLYTQHZQA-UHFFFAOYSA-N
Mol Weight 554.8 g/mol
Molecular Formula C34H50O6
Exact Mass 554.360739 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DhqBwBJTeGz
Name 2,5-Dimethoxy-4-{4-(octadecyloxy)methyl}-2,5-dioxocyclohexa-3,6-dienylbenzaldehyde
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H50O6
InChI InChI=1S/C34H50O6/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-40-26-28-21-32(37)29(23-31(28)36)30-24-33(38-2)27(25-35)22-34(30)39-3/h21-25H,4-20,26H2,1-3H3
InChIKey PBQNRDLYTQHZQA-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cbdv.200690059
Molecular Weight 554.768 g/mol
SMILES C(c1c(cc(c(c1)OC)C=1C(C=C(C(C1)=O)COCCCCCCCCCCCCCCCCCC)=O)OC)=O
SPLASH splash10-052f-9100000000-d56f0b76c799b15cfbac
Source of Spectrum CBD-3-564-12g
Synonyms 2,5-Dimethoxy-4'-((octadecyloxy)methyl)-2',5'-dioxo-2',5'-dihydro-[1,1'-biphenyl]-4-carbaldehyde
Wiley ID 1790282