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Isobutyl undecyl carbonate
SpectraBase Compound ID 1kJkBz9yFcc
InChI InChI=1S/C16H32O3/c1-4-5-6-7-8-9-10-11-12-13-18-16(17)19-14-15(2)3/h15H,4-14H2,1-3H3
InChIKey PDZSUBUKRMDFPM-UHFFFAOYSA-N
Mol Weight 272.4 g/mol
Molecular Formula C16H32O3
Exact Mass 272.235145 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DUc3GIf0HAo
Name Isobutyl undecyl carbonate
Comments Computed using HOSE algorithm
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Exact Mass 272.235144887 u
Formula C16H32O3
InChI InChI=1S/C16H32O3/c1-4-5-6-7-8-9-10-11-12-13-18-16(17)19-14-15(2)3/h15H,4-14H2,1-3H3
InChIKey PDZSUBUKRMDFPM-UHFFFAOYSA-N
SMILES C(OC(=O)OCCCCCCCCCCC)C(C)C