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6,7,8,9-TETRAHYDRO-5H-[1,2,4]-TRIAZOLO-[1,5-A]-AZEPINE-2-ACETIC-ACID-ETHYLESTER
SpectraBase Compound ID 7uhN26leBPX
InChI InChI=1S/C11H17N3O2/c1-2-16-11(15)8-9-12-10-6-4-3-5-7-14(10)13-9/h2-8H2,1H3
InChIKey GWMMMTXCNAQABT-UHFFFAOYSA-N
Mol Weight 223.28 g/mol
Molecular Formula C11H17N3O2
Exact Mass 223.132077 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E2eq4OrvkA6
Name 6,7,8,9-TETRAHYDRO-5H-[1,2,4]-TRIAZOLO-[1,5-A]-AZEPINE-2-ACETIC-ACID-ETHYLESTER
Compound Number 12D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H17N3O2
InChI InChI=1S/C11H17N3O2/c1-2-16-11(15)8-9-12-10-6-4-3-5-7-14(10)13-9/h2-8H2,1H3
InChIKey GWMMMTXCNAQABT-UHFFFAOYSA-N
Literature Reference Author Y.A.AL-SOUD,N.A.AL-MASOUDI,A.EL-RAHMAN,S.FERWANAH
Literature Reference Citation BIOORG.MED.CHEM.,11,1701(2003)
Literature Reference DOI 10.1016/S0968-0896(03)00043-9
Molecular Weight 223.275 g/mol
Sample ID 29118
Solvent CDCl3