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cis-6-Acetyl-2,2,3,6-tetramethylcyclohexaneone
SpectraBase Compound ID 8sfjSBd7ZdJ
InChI InChI=1S/C12H20O2/c1-8-6-7-12(5,9(2)13)10(14)11(8,3)4/h8H,6-7H2,1-5H3/t8-,12-/m1/s1
InChIKey QNOZFBCEYGXKSP-PRHODGIISA-N
Mol Weight 196.29 g/mol
Molecular Formula C12H20O2
Exact Mass 196.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9F9NFL4mGJX
Name cis-6-Acetyl-2,2,3,6-tetramethylcyclohexaneone
Alternate Name(s) (3R,6R)-6-acetyl-2,2,3,6-tetramethylcyclohexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O2
InChI InChI=1S/C12H20O2/c1-8-6-7-12(5,9(2)13)10(14)11(8,3)4/h8H,6-7H2,1-5H3/t8-,12-/m1/s1
InChIKey QNOZFBCEYGXKSP-PRHODGIISA-N
Molecular Weight 196.290 g/mol
SMILES [C@@]1(C(C(C)(C)[C@@](CC1)(C)[H])=O)(C(=O)C)C
SPLASH splash10-0fsu-9500000000-bd422d3435449eba2d5b
Source of Spectrum AT-33-6138-9
Wiley ID 836373