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3-(4'-ACETYL-5'-METHYL-5'-PHENYL-1',3',4'-OXADIAZOLIN-2'-YL)-7-CHLORO-1,3-DIHYDRO-1-METHYL-5-PHENYL-2H-1,4-BENZODIAZEPIN-2-ONE

View entire compound with spectra: 1 NMR

3-(4'-ACETYL-5'-METHYL-5'-PHENYL-1',3',4'-OXADIAZOLIN-2'-YL)-7-CHLORO-1,3-DIHYDRO-1-METHYL-5-PHENYL-2H-1,4-BENZODIAZEPIN-2-ONE
SpectraBase Compound ID 6LLjtnTI7HL
InChI InChI=1S/C27H23ClN4O3/c1-17(33)32-27(2,19-12-8-5-9-13-19)35-25(30-32)24-26(34)31(3)22-15-14-20(28)16-21(22)23(29-24)18-10-6-4-7-11-18/h4-16,24H,1-3H3
InChIKey YDUQFVICXMWAKV-UHFFFAOYSA-N
Mol Weight 486.96 g/mol
Molecular Formula C27H23ClN4O3
Exact Mass 486.145868 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7E6nrCK0OAo
Name 3-(4'-ACETYL-5'-METHYL-5'-PHENYL-1',3',4'-OXADIAZOLIN-2'-YL)-7-CHLORO-1,3-DIHYDRO-1-METHYL-5-PHENYL-2H-1,4-BENZODIAZEPIN-2-ONE
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H23ClN4O3
InChI InChI=1S/C27H23ClN4O3/c1-17(33)32-27(2,19-12-8-5-9-13-19)35-25(30-32)24-26(34)31(3)22-15-14-20(28)16-21(22)23(29-24)18-10-6-4-7-11-18/h4-16,24H,1-3H3
InChIKey YDUQFVICXMWAKV-UHFFFAOYSA-N
Literature Reference Author M.A.BERGHOT
Literature Reference Citation J.CHIN.CHEM.SOC.,48,913(2001)
Literature Reference DOI 10.1002/jccs.200100133
Molecular Weight 486.958 g/mol
Solvent CF3COOD
Source File Reference UWMS3385