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Isopentylalcohol
SpectraBase Compound ID 5kqafXtBxsG
InChI InChI=1S/C5H12O/c1-5(2)3-4-6/h5-6H,3-4H2,1-2H3
InChIKey PHTQWCKDNZKARW-UHFFFAOYSA-N
Mol Weight 88.15 g/mol
Molecular Formula C5H12O
Exact Mass 88.088815 g/mol

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2RinNjzV66d
Name ISOPENTYLALCOHOL;3-METHYL-1-BUTANOL
CAS Registry Number 123-51-3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C5H12O
InChI InChI=1S/C5H12O/c1-5(2)3-4-6/h5-6H,3-4H2,1-2H3
InChIKey PHTQWCKDNZKARW-UHFFFAOYSA-N
Literature Reference Author J.K.CRANDALL,M.A.CENTENO
Literature Reference Citation J.ORG.CHEM.,44,1183(1979)
Literature Reference DOI 10.1021/jo01321a042
Solvent NEAT
Source File Reference UNIO686