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3-[4-(4-pentylcyclohexyl)phenyl]-5-(4-pentylphenyl)-1,2,4-oxadiazole
SpectraBase Compound ID 7jOL01gepwT
InChI InChI=1S/C30H40N2O/c1-3-5-7-9-23-11-15-25(16-12-23)26-19-21-27(22-20-26)29-31-30(33-32-29)28-17-13-24(14-18-28)10-8-6-4-2/h13-14,17-23,25H,3-12,15-16H2,1-2H3
InChIKey ZCRCQBMBGWMEDR-UHFFFAOYSA-N
Mol Weight 444.7 g/mol
Molecular Formula C30H40N2O
Exact Mass 444.314064 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KQVFsrq030f
Name 3-[4-(4-pentylcyclohexyl)phenyl]-5-(4-pentylphenyl)-1,2,4-oxadiazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H40N2O
InChI InChI=1S/C30H40N2O/c1-3-5-7-9-23-11-15-25(16-12-23)26-19-21-27(22-20-26)29-31-30(33-32-29)28-17-13-24(14-18-28)10-8-6-4-2/h13-14,17-23,25H,3-12,15-16H2,1-2H3
InChIKey ZCRCQBMBGWMEDR-UHFFFAOYSA-N
Molecular Weight 444.663 g/mol
SMILES C(CCCC)C1CCC(CC1)c1ccc(cc1)-c1noc(n1)-c1ccc(cc1)CCCCC
SPLASH splash10-002f-7901100000-78f281a011f98aa0f9ac
Synonyms 3-[4-(4-amylcyclohexyl)phenyl]-5-(4-amylphenyl)-1,2,4-oxadiazole
Wiley ID 1438496