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Cycloheptanone, 3-(2-oxopropyl)-
SpectraBase Compound ID QVySXOhuBB
InChI InChI=1S/C10H16O2/c1-8(11)6-9-4-2-3-5-10(12)7-9/h9H,2-7H2,1H3
InChIKey BOELKTAUJTUZPI-UHFFFAOYSA-N
Mol Weight 168.24 g/mol
Molecular Formula C10H16O2
Exact Mass 168.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LYYmF80OXUX
Name Cycloheptanone, 3-(2-oxopropyl)-
Alternate Name(s) 3-(2-oxidanylidenepropyl)cycloheptan-1-one 3-(2-oxopropyl)-1-cycloheptanone 3-(2-oxopropyl)cycloheptan-1-one 3-(2-Oxopropyl)cycloheptanone 3-Acetonylcycloheptanone
CAS Registry Number 66921-76-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16O2
InChI InChI=1S/C10H16O2/c1-8(11)6-9-4-2-3-5-10(12)7-9/h9H,2-7H2,1H3
InChIKey BOELKTAUJTUZPI-UHFFFAOYSA-N
Molecular Weight 168.236 g/mol
SMILES C1(CC(CCCC1)CC(C)=O)=O
SPLASH splash10-01ox-9400000000-e32d93ace252b597cef1
Source of Spectrum W5-1989-36173-29363
Wiley ID 1164635