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1,3-DIMETHYL-ANTI-1,3-PROPANDIOL

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1,3-DIMETHYL-ANTI-1,3-PROPANDIOL
SpectraBase Compound ID 1i3RSkkozeS
InChI InChI=1S/C5H12O2/c1-4(6)3-5(2)7/h4-7H,3H2,1-2H3/t4-,5+
InChIKey GTCCGKPBSJZVRZ-SYDPRGILSA-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 5cZb4bVbBLS
Name 1,3-DIMETHYL-ANTI-1,3-PROPANDIOL
Compound Number 3B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C5H12O2
InChI InChI=1S/C5H12O2/c1-4(6)3-5(2)7/h4-7H,3H2,1-2H3/t4-,5+
InChIKey GTCCGKPBSJZVRZ-SYDPRGILSA-N
Literature Reference Author N.HAYASHI,Y.KOBAYASHI,Y.KISHI
Literature Reference Citation ORG.LETTERS,3,2253(2001)
Literature Reference DOI 10.1021/ol010110q
Molecular Weight 104.149 g/mol
Solvent (S)-DMBA
Source File Reference UWSI26872