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Propargylalcohol
SpectraBase Compound ID H6fwKPZI5R2
InChI InChI=1S/C3H4O/c1-2-3-4/h1,4H,3H2
InChIKey TVDSBUOJIPERQY-UHFFFAOYSA-N
Mol Weight 56.06 g/mol
Molecular Formula C3H4O
Exact Mass 56.026215 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID D9aAU6rlIRL
Name Propargyl alcohol
Acquisition Mode SIMULTANEOUS
CAS Registry Number 107-19-7
ChEBI ID 28905
Comments 100 mM Propargyl alcohol - Sigma-Aldrich Solvent D2O Buffer sodium phosphate Cytocide sodium azide Reference DSS; pH 7.4, temperature 298 K
Copyright Database Compilation Copyright © 2021-2024 John Wiley & Sons, Inc. All Rights Reserved.
Data Source Madison Metabolomics Consortium
Formula C3 H4 O
IUPAC Name prop-2-yn-1-ol
InChI InChI=1S/C3H4O/c1-2-3-4/h1,4H,3H2
InChIKey TVDSBUOJIPERQY-UHFFFAOYSA-N
KEGG Compound ID C05986
KEGG Pathways PATH: ko00640 Propanoate metabolism
PubChem Compound ID 7859
SMILES C#CCO
Source File Reference bmse000363