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N-(3-chlorophenyl)-4-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)butanamide
SpectraBase Compound ID CouUGQeqXR6
InChI InChI=1S/C15H17ClIN3O/c1-10-15(17)11(2)20(19-10)8-4-7-14(21)18-13-6-3-5-12(16)9-13/h3,5-6,9H,4,7-8H2,1-2H3,(H,18,21)
InChIKey APQUALALABIBFE-UHFFFAOYSA-N
Mol Weight 417.68 g/mol
Molecular Formula C15H17ClIN3O
Exact Mass 417.010485 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Ig3O1avfkQ
Name N-(3-chlorophenyl)-4-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)butanamide
Alternate Name(s) N-(3-chlorophenyl)-4-(4-iodo-3,5-dimethyl-1-pyrazolyl)butanamide N-(3-chlorophenyl)-4-(4-iodo-3,5-dimethylpyrazol-1-yl)butanamide N-(3-chlorophenyl)-4-(4-iodo-3,5-dimethyl-pyrazol-1-yl)butanamide N-(3-chlorophenyl)-4-(4-iodanyl-3,5-dimethyl-pyrazol-1-yl)butanamide
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Formula C15H17ClIN3O
InChI InChI=1S/C15H17ClIN3O/c1-10-15(17)11(2)20(19-10)8-4-7-14(21)18-13-6-3-5-12(16)9-13/h3,5-6,9H,4,7-8H2,1-2H3,(H,18,21)
InChIKey APQUALALABIBFE-UHFFFAOYSA-N
Molecular Weight 417.678 g/mol
SMILES N(c1cc(ccc1)Cl)C(=O)CCC[n]1nc(c(c1C)I)C
SPLASH splash10-000e-4490100000-7e3d54626e8106a313d7
Source of Spectrum IY-2-5092-7
Wiley ID 1658910