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2-Methylcycloheptanone
SpectraBase Compound ID 3MeRzrx4cT7
InChI InChI=1S/C8H14O/c1-7-5-3-2-4-6-8(7)9/h7H,2-6H2,1H3
InChIKey FDMAFOTXGNYBFG-UHFFFAOYSA-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 HWYj14uCGG0
Name CYCLOHEPTANONE, 2-METHYL-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H14O
InChI InChI=1S/C8H14O/c1-7-5-3-2-4-6-8(7)9/h7H,2-6H2,1H3
InChIKey FDMAFOTXGNYBFG-UHFFFAOYSA-N
Molecular Weight 126.1041
SMILES C1C(=O)C(C)CCCC1
SPLASH splash10-052f-9000000000-c6d48e7329007feb38d4
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany