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2,4-Pentanediol
SpectraBase Compound ID 8zYVkbD7Iv1
InChI InChI=1S/C5H12O2/c1-4(6)3-5(2)7/h4-7H,3H2,1-2H3
InChIKey GTCCGKPBSJZVRZ-UHFFFAOYSA-N
Mol Weight 104.15 g/mol
Molecular Formula C5H12O2
Exact Mass 104.08373 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7qI47sjhJ1E
Name (2R,4R)-2,4-Pentanediol
CAS Registry Number 42075-32-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C5H12O2
InChI InChI=1S/C5H12O2/c1-4(6)3-5(2)7/h4-7H,3H2,1-2H3
InChIKey GTCCGKPBSJZVRZ-UHFFFAOYSA-N
Instrument Name see comment
Literature Reference J, Reuben, J. Am. Chem. Soc. 107, 1756 (1985).
NMR Standard DMSO-D6
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6