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cis-2-Acetoxy-1-methylbicyclo[4.4.0]decene
SpectraBase Compound ID Bc7CMc8iBjW
InChI InChI=1S/C13H20O2/c1-10(14)15-12-8-5-7-11-6-3-4-9-13(11,12)2/h8,11H,3-7,9H2,1-2H3/t11-,13-/m1/s1
InChIKey NVCHCWXCBUQDTG-DGCLKSJQSA-N
Mol Weight 208.3 g/mol
Molecular Formula C13H20O2
Exact Mass 208.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D63nyBHrvha
Name cis-2-Acetoxy-1-methylbicyclo[4.4.0]decene
Alternate Name(s) cis-2-Acetoxy-1-methylbicyclo[4.4.0]dec-2-ene Acetic acid (4aR,8aS)-8a-methyl-1,4,4a,5,6,7,8,8a-octahydro-naphthalen-2-yl ester Acetic acid (4aR,8aR)-8a-methyl-3,4,4a,5,6,7,8,8a-octahydro-naphthalen-2-yl ester cis-3-Acetoxy-1-methylbicyclo[4.4.0]dec-2-ene cis-3-Acetoxy-1-methylbicyclo[4.4.0]dec-3-ene
Comments Less than 3 mono-isotopic peaks; Note: The molecular formula of the structure shown is C13H20O2 - which differs from the formula reported for the mass spectrum (C13H19DO2)
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Formula C13H19DO2
InChI InChI=1S/C13H20O2/c1-10(14)15-12-8-5-7-11-6-3-4-9-13(11,12)2/h8,11H,3-7,9H2,1-2H3/t11-,13-/m1/s1
InChIKey NVCHCWXCBUQDTG-DGCLKSJQSA-N
Molecular Weight 208.301 g/mol
SMILES C(C)(=O)OC=1[C@@]2(CCCC[C@@]2(CCC1)[H])C
SPLASH splash10-0udi-0900000000-8bb071c6a2675a349bb6
Source of Spectrum KC-0-972-17
Wiley ID 821088