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Bromoacetic acid, tetradecyl ester
SpectraBase Compound ID 98FS2iVLlgs
InChI InChI=1S/C16H31BrO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-19-16(18)15-17/h2-15H2,1H3
InChIKey JBGQZMPANSYTHT-UHFFFAOYSA-N
Mol Weight 335.33 g/mol
Molecular Formula C16H31BrO2
Exact Mass 334.150743 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CRpGE6fahcP
Name Bromoacetic acid, tetradecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 334.150743236 u
Formula C16H31BrO2
InChI InChI=1S/C16H31BrO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-19-16(18)15-17/h2-15H2,1H3
InChIKey JBGQZMPANSYTHT-UHFFFAOYSA-N
Molecular Weight 335.326 g/mol
SMILES C(Br)C(=O)OCCCCCCCCCCCCCC