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Carbonic acid, butyl hexyl ester
SpectraBase Compound ID 8ByxMOALXAC
InChI InChI=1S/C11H22O3/c1-3-5-7-8-10-14-11(12)13-9-6-4-2/h3-10H2,1-2H3
InChIKey CTGITZJPOKABCS-UHFFFAOYSA-N
Mol Weight 202.29 g/mol
Molecular Formula C11H22O3
Exact Mass 202.156895 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1NzZ5vr4uXu
Name Carbonic acid, butyl hexyl ester
Comments Computed using HOSE algorithm
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Exact Mass 202.156894565 u
Formula C11H22O3
InChI InChI=1S/C11H22O3/c1-3-5-7-8-10-14-11(12)13-9-6-4-2/h3-10H2,1-2H3
InChIKey CTGITZJPOKABCS-UHFFFAOYSA-N
Molecular Weight 202.294 g/mol
SMILES CCCCOC(OCCCCCC)=O