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2-Methylcyclohexanone
SpectraBase Compound ID H3YZXTLJ6mG
InChI InChI=1S/C7H12O/c1-6-4-2-3-5-7(6)8/h6H,2-5H2,1H3
InChIKey LFSAPCRASZRSKS-UHFFFAOYSA-N
Mol Weight 112.17 g/mol
Molecular Formula C7H12O
Exact Mass 112.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AV757G3HCu7
Name Cyclohexanone, 2-methyl-
CAS Registry Number 583-60-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12O
InChI InChI=1S/C7H12O/c1-6-4-2-3-5-7(6)8/h6H,2-5H2,1H3
InChIKey LFSAPCRASZRSKS-UHFFFAOYSA-N
Molecular Weight 112.172 g/mol
SMILES C1(=O)C(C)CCCC1
SPLASH splash10-0693-9000000000-47df5db31417c9b26117
Source of Spectrum W5-1989-49858-15678
Synonyms .alpha.-Methylcyclohexanone 2-Methyl-1-cyclohexanone 2-Methyl-cyclohexanon 2-Methyl-cyclohexanon (german, dutch)o-methylcyclohexanone 2-Methylcyclohexan-1-one 2-Metilcicloesanone Methylanon o-Methylcyclohexanone Sexton B AI3-15915 EINECS 209-513-6 HSDB 2917 NSC 524
Wiley ID 1123352