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3-Mesityl-5-[3-mesityl-4-(3-mesityl-1,2,4-oxadiazol-5-yl)-5,5-dimethyl-2-isoxazolin-4-yl]-1,2,4-oxadiazole
SpectraBase Compound ID CVIMr0yclJS
InChI InChI=1S/C36H39N5O3/c1-18-12-21(4)27(22(5)13-18)30-36(35(10,11)44-39-30,33-37-31(40-42-33)28-23(6)14-19(2)15-24(28)7)34-38-32(41-43-34)29-25(8)16-20(3)17-26(29)9/h12-17H,1-11H3
InChIKey GVGDERKLYCVDNK-UHFFFAOYSA-N
Mol Weight 589.7 g/mol
Molecular Formula C36H39N5O3
Exact Mass 589.30529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G8lKhCP3TGa
Name 3-Mesityl-5-[3-mesityl-4-(3-mesityl-1,2,4-oxadiazol-5-yl)-5,5-dimethyl-2-isoxazolin-4-yl]-1,2,4-oxadiazole
CAS Registry Number 127877-44-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H39N5O3
InChI InChI=1S/C36H39N5O3/c1-18-12-21(4)27(22(5)13-18)30-36(35(10,11)44-39-30,33-37-31(40-42-33)28-23(6)14-19(2)15-24(28)7)34-38-32(41-43-34)29-25(8)16-20(3)17-26(29)9/h12-17H,1-11H3
InChIKey GVGDERKLYCVDNK-UHFFFAOYSA-N
Molecular Weight 589.740 g/mol
SMILES C1(c2nc(-c3c(cc(cc3C)C)C)no2)(c2nc(-c3c(cc(cc3C)C)C)no2)C(=NOC1(C)C)c1c(cc(cc1C)C)C
SPLASH splash10-03di-1910000000-ac978d9e779a48816d05
Source of Spectrum Y-26-1685-4
Synonyms 5-[5,5-dimethyl-3-(2,4,6-trimethylphenyl)-4-[3-(2,4,6-trimethylphenyl)-1,2,4-oxadiazol-5-yl]-1,2-oxazol-4-yl]-3-(2,4,6-trimethylphenyl)-1,2,4-oxadiazole 5-[5,5-dimethyl-3-(2,4,6-trimethylphenyl)-4-[3-(2,4,6-trimethylphenyl)-1,2,4-oxadiazol-5-yl]-4-isoxazolyl]-3-(2,4,6-trimethylphenyl)-1,2,4-oxadiazole 5-[5,5-dimethyl-3-(2,4,6-trimethylphenyl)-4-[3-(2,4,6-trimethylphenyl)-1,2,4-oxadiazol-5-yl]isoxazol-4-yl]-3-(2,4,6-trimethylphenyl)-1,2,4-oxadiazole
Wiley ID 1409266