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3,5-bis[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]benzoyl chloride
SpectraBase Compound ID 7YLP0fRsVkr
InChI InChI=1S/C31H29ClN4O3/c1-30(2,3)23-11-7-18(8-12-23)26-33-35-28(38-26)21-15-20(25(32)37)16-22(17-21)29-36-34-27(39-29)19-9-13-24(14-10-19)31(4,5)6/h7-17H,1-6H3
InChIKey ADAGFNXFVFEXRL-UHFFFAOYSA-N
Mol Weight 541.05 g/mol
Molecular Formula C31H29ClN4O3
Exact Mass 540.192819 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6hO0zgs1VbB
Name 3,5-bis[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]benzoyl chloride
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H29ClN4O3
InChI InChI=1S/C31H29ClN4O3/c1-30(2,3)23-11-7-18(8-12-23)26-33-35-28(38-26)21-15-20(25(32)37)16-22(17-21)29-36-34-27(39-29)19-9-13-24(14-10-19)31(4,5)6/h7-17H,1-6H3
InChIKey ADAGFNXFVFEXRL-UHFFFAOYSA-N
Molecular Weight 541.051 g/mol
SMILES c1(oc(-c2ccc(C(C)(C)C)cc2)nn1)-c1cc(-c2oc(-c3ccc(C(C)(C)C)cc3)nn2)cc(c1)C(=O)Cl
SPLASH splash10-002f-3000090000-3b364e087a346da23034
Source of Spectrum KC-0-711-15
Wiley ID 827697