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Spiro[bicyclo[2.2.2]octane-2,1'-[2]cyclopenten]-4'-one
SpectraBase Compound ID BIRZpT19HbS
InChI InChI=1S/C12H16O/c13-11-5-6-12(8-11)7-9-1-3-10(12)4-2-9/h5-6,9-10H,1-4,7-8H2
InChIKey IEXUJILPNQEBQS-UHFFFAOYSA-N
Mol Weight 176.26 g/mol
Molecular Formula C12H16O
Exact Mass 176.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 82EChzze9jv
Name Spiro[bicyclo[2.2.2]octane-2,1'-[2]cyclopenten]-4'-one
Alternate Name(s) Spiro(bicyclo[2.2.2]octane-2,1'[4]cyclopenten-3-one) Spiro[bicyclo[2.2.2]octane-2,1'-cyclopentan]-2'-en-4'-one
CAS Registry Number 111036-07-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O
InChI InChI=1S/C12H16O/c13-11-5-6-12(8-11)7-9-1-3-10(12)4-2-9/h5-6,9-10H,1-4,7-8H2
InChIKey IEXUJILPNQEBQS-UHFFFAOYSA-N
Molecular Weight 176.259 g/mol
SMILES C12(C=CC(C2)=O)C2CCC(C1)CC2
SPLASH splash10-002b-9600000000-cbf931c74d24fbc12f98
Source of Spectrum I-65-161-15
Wiley ID 1172751