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cis-3-oxo-8-methyltricyclo[5.4.0.1(1,4)]dodecane
SpectraBase Compound ID HR9niptSZEJ
InChI InChI=1S/C13H20O/c1-9-3-2-6-13-7-10(12(14)8-13)4-5-11(9)13/h9-11H,2-8H2,1H3
InChIKey DPQMXGROYZTRLB-UHFFFAOYSA-N
Mol Weight 192.3 g/mol
Molecular Formula C13H20O
Exact Mass 192.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2hnK5JzL9gk
Name cis-3-oxo-8-methyltricyclo[5.4.0.1(1,4)]dodecane
Alternate Name(s) trans-3-oxo-8-methyltricyclo[5.4.0.1(1,4)]dodecane 5-Methyltricyclo[7.2.1.0(1,6)]dodecan-10-one
CAS Registry Number 125556-18-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O
InChI InChI=1S/C13H20O/c1-9-3-2-6-13-7-10(12(14)8-13)4-5-11(9)13/h9-11H,2-8H2,1H3
InChIKey DPQMXGROYZTRLB-UHFFFAOYSA-N
Molecular Weight 192.302 g/mol
SMILES C123C(CCC(C3)C(C1)=O)C(C)CCC2
SPLASH splash10-0005-4900000000-d5d1e2d19cae393202c1
Source of Spectrum O-24-576-19
Wiley ID 1189019