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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 9KddNyYY4K0
Name Cycloheptanone, 2-methyl-
Alternate Name(s) 2-Methyl-1-cycloheptanone 2-Methylcycloheptan-1-one 2-Methylcycloheptanone
CAS Registry Number 932-56-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. 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 126.199 g/mol
SMILES C1(=O)C(CCCCC1)C
SPLASH splash10-0a4l-9000000000-2e1c7370243872c9df7d
Source of Spectrum A-1-729-1
Wiley ID 1130210