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Cycloheptanone
SpectraBase Compound ID CSim3R6VmMi
InChI InChI=1S/C7H12O/c8-7-5-3-1-2-4-6-7/h1-6H2
InChIKey CGZZMOTZOONQIA-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 9U3ZvTQbiWr
Name CYCLOHEPTANONE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C7H12O
InChI InChI=1S/C7H12O/c8-7-5-3-1-2-4-6-7/h1-6H2
InChIKey CGZZMOTZOONQIA-UHFFFAOYSA-N
Instrument Name CH5
Molecular Weight 112.0885
SMILES C1CCC(=O)CCC1
SPLASH splash10-0aou-9000000000-3b6e528aeace42948c01
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany