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TRANS-6-(BENZOTRIAZOL-1-YL)-5-PHENYL-3-CYCLOPROPYL-CYCLOHEX-2-ENONE
SpectraBase Compound ID AjwCQX4DRjL
InChI InChI=1S/C21H19N3O/c25-20-13-16(14-10-11-14)12-17(15-6-2-1-3-7-15)21(20)24-22-18-8-4-5-9-19(18)23-24/h1-9,13-14,17,21H,10-12H2/t17-,21-/m0/s1
InChIKey VFSPMTBZLZKSGW-UWJYYQICSA-N
Mol Weight 329.4 g/mol
Molecular Formula C21H19N3O
Exact Mass 329.152812 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID yUFO1RAnOg
Name TRANS-6-(BENZOTRIAZOL-1-YL)-5-PHENYL-3-CYCLOPROPYL-CYCLOHEX-2-ENONE
Compound Number III-A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H19N3O
InChI InChI=1S/C21H19N3O/c25-20-13-16(14-10-11-14)12-17(15-6-2-1-3-7-15)21(20)24-22-18-8-4-5-9-19(18)23-24/h1-9,13-14,17,21H,10-12H2/t17-,21-/m0/s1
InChIKey VFSPMTBZLZKSGW-UWJYYQICSA-N
Literature Reference Author A.V.SAMET,V.V.KACHALA,V.V.SEMENOV
Literature Reference Citation CHEM.HET.COMP.,33,1471(1997)
Literature Reference DOI 10.1007/bf02291653
Molecular Weight 329.401 g/mol
Solvent ACETONE-D6
Source File Reference UWMZ15089