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4-[[3-(3,5-DIMETHYL-1H-PYRAZOL-1-YL)-3-OXOPROPYL]-AMINO]-BENZENE-1-SULFONAMIDE
SpectraBase Compound ID LwzyuNobXqj
InChI InChI=1S/C14H18N4O3S/c1-10-9-11(2)18(17-10)14(19)7-8-16-12-3-5-13(6-4-12)22(15,20)21/h3-6,9,16H,7-8H2,1-2H3,(H2,15,20,21)
InChIKey SQGUOOCGLKRFBU-UHFFFAOYSA-N
Mol Weight 322.38 g/mol
Molecular Formula C14H18N4O3S
Exact Mass 322.109962 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IUkDuVh7KR9
Name 4-[[3-(3,5-DIMETHYL-1H-PYRAZOL-1-YL)-3-OXOPROPYL]-AMINO]-BENZENE-1-SULFONAMIDE
Compound Number 18
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H18N4O3S
InChI InChI=1S/C14H18N4O3S/c1-10-9-11(2)18(17-10)14(19)7-8-16-12-3-5-13(6-4-12)22(15,20)21/h3-6,9,16H,7-8H2,1-2H3,(H2,15,20,21)
InChIKey SQGUOOCGLKRFBU-UHFFFAOYSA-N
Literature Reference Author K.RUTKAUSKAS,A.ZUBRIENE,I.TUMOSIENE,K.KANTMINIENE,M.KAZEMEKA ITE,A.SMIRNOV,J.KAZO
Literature Reference Citation MOLECULES,19,17356(2014)
Literature Reference DOI 10.3390/molecules191117356
Molecular Weight 322.382 g/mol
Solvent DMSO-D6
Source File Reference UWLU81528