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1-(4-CHLOROPHENYL)-3-(5-TETRAZOYL)-1-BUTANONE

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1-(4-CHLOROPHENYL)-3-(5-TETRAZOYL)-1-BUTANONE
SpectraBase Compound ID EYGoFDeYl5b
InChI InChI=1S/C11H11ClN4O/c12-9-6-4-8(5-7-9)10(17)2-1-3-11-13-15-16-14-11/h4-7H,1-3H2,(H,13,14,15,16)
InChIKey GCGWTEUMHUMMQX-UHFFFAOYSA-N
Mol Weight 250.69 g/mol
Molecular Formula C11H11ClN4O
Exact Mass 250.062139 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 65sNXOjJ1Q5
Name 1-(4-CHLOROPHENYL)-3-(5-TETRAZOYL)-1-BUTANONE
Compound Number 37
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H11ClN4O
InChI InChI=1S/C11H11ClN4O/c12-9-6-4-8(5-7-9)10(17)2-1-3-11-13-15-16-14-11/h4-7H,1-3H2,(H,13,14,15,16)
InChIKey GCGWTEUMHUMMQX-UHFFFAOYSA-N
Literature Reference Author J.J.LEE,L.F.HUANG,K.ZAW,L.BAUER
Literature Reference Citation J.HETCYCL.CHEM.,35,81(1998)
Literature Reference DOI 10.1002/jhet.5570350116
Molecular Weight 250.688 g/mol
Solvent CDCl3
Source File Reference UWCS25568