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2-tert-Butyl-2-hydroxy-4-keto-5,5-dimethyl-hexanenitrile
SpectraBase Compound ID 2Kp1ELPIvEp
InChI InChI=1S/C12H21NO2/c1-10(2,3)9(14)7-12(15,8-13)11(4,5)6/h15H,7H2,1-6H3
InChIKey QZURAYOGRDLLGR-UHFFFAOYSA-N
Mol Weight 211.3 g/mol
Molecular Formula C12H21NO2
Exact Mass 211.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HjgylxWe20C
Name 2-tert-Butyl-2-hydroxy-4-keto-5,5-dimethyl-hexanenitrile
Alternate Name(s) 2-tert-Butyl-2-hydroxy-5,5-dimethyl-4-oxo-hexanenitrile 2-tert-Butyl-5,5-dimethyl-2-oxidanyl-4-oxidanylidene-hexanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H21NO2
InChI InChI=1S/C12H21NO2/c1-10(2,3)9(14)7-12(15,8-13)11(4,5)6/h15H,7H2,1-6H3
InChIKey QZURAYOGRDLLGR-UHFFFAOYSA-N
Molecular Weight 211.305 g/mol
SMILES OC(CC(C(C)(C)C)=O)(C#N)C(C)(C)C
SPLASH splash10-0a4i-9300000000-fed6e4f2244ca78654c4
Source of Spectrum F9-1992-1598-2
Wiley ID 1566600