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(2S,3S)-3-METHYL-1,3-PENTANEDIOL
SpectraBase Compound ID Jy7gafuxTbv
InChI InChI=1S/C6H14O2/c1-3-6(8)5(2)4-7/h5-8H,3-4H2,1-2H3/t5-,6-/m1/s1
InChIKey SPXWGAHNKXLXAP-PHDIDXHHSA-N
Mol Weight 118.18 g/mol
Molecular Formula C6H14O2
Exact Mass 118.09938 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4qekOpFuy54
Name (2S,3S)-3-METHYL-1,3-PENTANEDIOL
Comments 8
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H14O2
InChI InChI=1S/C6H14O2/c1-3-6(8)5(2)4-7/h5-8H,3-4H2,1-2H3/t5-,6-/m1/s1
InChIKey SPXWGAHNKXLXAP-PHDIDXHHSA-N
Instrument Name Varian XL-100
Literature Reference F.SZURDOKI, L.NOVAK, E.BAITZ-GACS, CS.SZANTAY (1992) Acta Chimica Hungarica:v.129, N2, 303-309.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d