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MSANHHHQJYQEOK-KNVOCYPGSA-N
SpectraBase Compound ID GY1Sfi7iwea
InChI InChI=1S/C8H14O/c1-6-3-7(2)5-8(9)4-6/h6-7H,3-5H2,1-2H3/t6-,7+
InChIKey MSANHHHQJYQEOK-KNVOCYPGSA-N
Mol Weight 126.2 g/mol
Molecular Formula C8H14O
Exact Mass 126.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8yDOm6d9pIx
Name 3,5-Dimethylcyclohexanone
CAS Registry Number 7214-52-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O
InChI InChI=1S/C8H14O/c1-6-3-7(2)5-8(9)4-6/h6-7H,3-5H2,1-2H3/t6-,7+
InChIKey MSANHHHQJYQEOK-KNVOCYPGSA-N
Molecular Weight 126.199 g/mol
SMILES [C@@]1(CC(C[C@@](C1)(C)[H])=O)(C)[H]
SPLASH splash10-05mo-9100000000-6b95819361b6380b1a16
Source of Spectrum AD-0-2532-0
Synonyms (3R,5S)-3,5-dimethyl-1-cyclohexanone (3R,5S)-3,5-dimethylcyclohexan-1-one (3R,5S)-3,5-dimethylcyclohexanone cis-3,5-Dimethylcyclohexanone Cyclohexanone, 3,5-dimethyl-, cis-
Wiley ID 1426809