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1H-Pyrazole-1-butanamide, N-(1,3-benzodioxol-5-yl)-4-iodo-3,5-dimethyl-
SpectraBase Compound ID 6Ho2fEicvLC
InChI InChI=1S/C16H18IN3O3/c1-10-16(17)11(2)20(19-10)7-3-4-15(21)18-12-5-6-13-14(8-12)23-9-22-13/h5-6,8H,3-4,7,9H2,1-2H3,(H,18,21)
InChIKey DLGPSCLUDHTGME-UHFFFAOYSA-N
Mol Weight 427.24 g/mol
Molecular Formula C16H18IN3O3
Exact Mass 427.039286 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HiG1ypjNK0P
Name 1H-Pyrazole-1-butanamide, N-(1,3-benzodioxol-5-yl)-4-iodo-3,5-dimethyl-
Alternate Name(s) N-(2H-1,3-benzodioxol-5-yl)-4-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)butanamide N-(1,3-benzodioxol-5-yl)-4-(4-iodo-3,5-dimethyl-1-pyrazolyl)butanamide N-(1,3-benzodioxol-5-yl)-4-(4-iodo-3,5-dimethylpyrazol-1-yl)butanamide N-(1,3-benzodioxol-5-yl)-4-(4-iodo-3,5-dimethyl-pyrazol-1-yl)butanamide N-(1,3-benzodioxol-5-yl)-4-(4-iodanyl-3,5-dimethyl-pyrazol-1-yl)butanamide
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Formula C16H18IN3O3
InChI InChI=1S/C16H18IN3O3/c1-10-16(17)11(2)20(19-10)7-3-4-15(21)18-12-5-6-13-14(8-12)23-9-22-13/h5-6,8H,3-4,7,9H2,1-2H3,(H,18,21)
InChIKey DLGPSCLUDHTGME-UHFFFAOYSA-N
Molecular Weight 427.242 g/mol
SMILES N(c1ccc2c(c1)OCO2)C(=O)CCC[n]1nc(c(c1C)I)C
SPLASH splash10-000f-7790000000-6c57fb87ee4e34bea7fa
Source of Spectrum IY-2-5198-5
Wiley ID 1659968