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2-(1,1,2-Trimethylpropyl)cyclohexanone
SpectraBase Compound ID LlKRCPtf3kd
InChI InChI=1S/C12H22O/c1-9(2)12(3,4)10-7-5-6-8-11(10)13/h9-10H,5-8H2,1-4H3
InChIKey SSXVZWJKPLVQKF-UHFFFAOYSA-N
Mol Weight 182.31 g/mol
Molecular Formula C12H22O
Exact Mass 182.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 987Kp88XESN
Name 2-(1,1,2-Trimethylpropyl)cyclohexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22O
InChI InChI=1S/C12H22O/c1-9(2)12(3,4)10-7-5-6-8-11(10)13/h9-10H,5-8H2,1-4H3
InChIKey SSXVZWJKPLVQKF-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cber.19801131208
Molecular Weight 182.307 g/mol
SMILES C1C(C(CCC1)C(C(C)C)(C)C)=O
SPLASH splash10-0002-9200000000-90c97de2103c2401c1c8
Source of Spectrum K-113-3753-45
Synonyms 2-(2,3-dimethylbutan-2-yl)cyclohexan-1-one
Wiley ID 1792628