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2-[(1,5-dimethyl-1H-pyrazol-3-yl)carbonyl]-N-isobutylhydrazinecarbothioamide
SpectraBase Compound ID LjZ6S3ZFIcf
InChI InChI=1S/C11H19N5OS/c1-7(2)6-12-11(18)14-13-10(17)9-5-8(3)16(4)15-9/h5,7H,6H2,1-4H3,(H,13,17)(H2,12,14,18)
InChIKey FKXONPDHABFWMQ-UHFFFAOYSA-N
Mol Weight 269.37 g/mol
Molecular Formula C11H19N5OS
Exact Mass 269.131031 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AQHyVgAnjrN
Name 2-[(1,5-Dimethyl-1H-pyrazol-3-yl)carbonyl]-N-isobutylhydrazinecarbothioamide
Comments Computed using HOSE algorithm
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Exact Mass 269.131031425 u
Formula C11H19N5OS
InChI InChI=1S/C11H19N5OS/c1-7(2)6-12-11(18)14-13-10(17)9-5-8(3)16(4)15-9/h5,7H,6H2,1-4H3,(H,13,17)(H2,12,14,18)
InChIKey FKXONPDHABFWMQ-UHFFFAOYSA-N
Molecular Weight 269.367 g/mol
SMILES N(C(C1=NN(C)C(=C1)C)=O)NC(=S)NCC(C)C