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4-isopropyl-7-methyl-5-oxooctanenitrile

View entire compound with spectra: 2 NMR, and 1 FTIR

4-isopropyl-7-methyl-5-oxooctanenitrile
SpectraBase Compound ID JZXKdzcDXoT
InChI InChI=1S/C12H21NO/c1-9(2)8-12(14)11(10(3)4)6-5-7-13/h9-11H,5-6,8H2,1-4H3
InChIKey BKYCUQSADDTGFZ-UHFFFAOYSA-N
Mol Weight 195.31 g/mol
Molecular Formula C12H21NO
Exact Mass 195.162314 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID KLOMR8SFoFt
Name 4-ISOPROPYL-7-METHYL-5-OXOOCTANENITRILE
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Catalog Number S58354
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H21NO
InChI InChI=1S/C12H21NO/c1-9(2)8-12(14)11(10(3)4)6-5-7-13/h9-11H,5-6,8H2,1-4H3
InChIKey BKYCUQSADDTGFZ-UHFFFAOYSA-N
Molecular Weight 195.306000
Synonyms OCTANENITRILE, 4-ISOPROPYL- 7-METHYL-5-OXO-,
Technique CAPILLARY CELL: NEAT