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1,4-bis(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)butan-1-one
SpectraBase Compound ID Fw22XG19ZLW
InChI InChI=1S/C14H18I2N4O/c1-8-13(15)10(3)19(17-8)7-5-6-12(21)20-11(4)14(16)9(2)18-20/h5-7H2,1-4H3
InChIKey RETZQQWBHNURHL-UHFFFAOYSA-N
Mol Weight 512.13 g/mol
Molecular Formula C14H18I2N4O
Exact Mass 511.957001 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CdJCjIE4iqR
Name 1,4-bis(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)butan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18I2N4O
InChI InChI=1S/C14H18I2N4O/c1-8-13(15)10(3)19(17-8)7-5-6-12(21)20-11(4)14(16)9(2)18-20/h5-7H2,1-4H3
InChIKey RETZQQWBHNURHL-UHFFFAOYSA-N
Molecular Weight 512.134 g/mol
SMILES c1([n](nc(c1I)C)C(=O)CCC[n]1nc(c(c1C)I)C)C
SPLASH splash10-0006-4190000000-1a010d61357613ad4870
Source of Spectrum IY-2-5011-0
Synonyms 1H-Pyrazole, 4-iodo-1-[4-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)-1-oxobutyl]-3,5-dimethyl-
Wiley ID 1658093