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4-[3-(1H-IMIDAZOL-1-YL)-PROPYL]-5-METHYL-2,4-DIHYDRO-3H-1,2,4-TRIAZOL-3-ONE
SpectraBase Compound ID HumNg9peIis
InChI InChI=1S/C9H13N5O/c1-8-11-12-9(15)14(8)5-2-4-13-6-3-10-7-13/h3,6-7H,2,4-5H2,1H3,(H,12,15)
InChIKey JGYUAJAJTMOGFJ-UHFFFAOYSA-N
Mol Weight 207.24 g/mol
Molecular Formula C9H13N5O
Exact Mass 207.11201 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4uUXuUIgvht
Name 4-[3-(1H-IMIDAZOL-1-YL)-PROPYL]-5-METHYL-2,4-DIHYDRO-3H-1,2,4-TRIAZOL-3-ONE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H13N5O
InChI InChI=1S/C9H13N5O/c1-8-11-12-9(15)14(8)5-2-4-13-6-3-10-7-13/h3,6-7H,2,4-5H2,1H3,(H,12,15)
InChIKey JGYUAJAJTMOGFJ-UHFFFAOYSA-N
Literature Reference Author H.BEKTAS,N.KARAALI,D.SAHIN,A.DEMIRBAS,S.A.KARAOGLU,N.DEMIRBA S
Literature Reference Citation MOLECULES,15,2427(2010)
Literature Reference DOI 10.3390/molecules15042427
Molecular Weight 207.235 g/mol
Sample ID 70251
Solvent DMSO-D6