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trans-5-tert-Butyl-2-isopropylcyclohexanone
SpectraBase Compound ID HymjmzsDoyz
InChI InChI=1S/C13H24O/c1-9(2)11-7-6-10(8-12(11)14)13(3,4)5/h9-11H,6-8H2,1-5H3/t10-,11+/m1/s1
InChIKey ABGSLGKEPNVPPA-MNOVXSKESA-N
Mol Weight 196.33 g/mol
Molecular Formula C13H24O
Exact Mass 196.182715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GVoWf5dUEqo
Name trans-5-tert-Butyl-2-isopropylcyclohexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H24O
InChI InChI=1S/C13H24O/c1-9(2)11-7-6-10(8-12(11)14)13(3,4)5/h9-11H,6-8H2,1-5H3/t10-,11+/m1/s1
InChIKey ABGSLGKEPNVPPA-MNOVXSKESA-N
Molecular Weight 196.334 g/mol
SMILES C1([C@@](CC[C@](C1)(C(C)(C)C)[H])(C(C)C)[H])=O
SPLASH splash10-0006-9500000000-b5e6f24ebbd735c0a18a
Source of Spectrum C-115-7673-15
Synonyms (2S,5R)-5-tert-butyl-2-isopropylcyclohexanone
Wiley ID 1193981