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E-2,6-dimethyl-8-(4-methoxyphenoxy)-5-acetoxy-6-octen-3-yne-2-ol
SpectraBase Compound ID 3nNugyGtfRJ
InChI InChI=1S/C19H24O5/c1-14(18(24-15(2)20)10-12-19(3,4)21)11-13-23-17-8-6-16(22-5)7-9-17/h6-9,11,18,21H,13H2,1-5H3/b14-11+
InChIKey QDNMJRLBKLAKKX-SDNWHVSQSA-N
Mol Weight 332.4 g/mol
Molecular Formula C19H24O5
Exact Mass 332.162374 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FAoykzjw4UK
Name E-2,6-Dimethyl-8-(4-methoxyphenoxy)-5-acetoxy-6-octen-3-yne-2-ol
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 332.162373868 u
Formula C19H24O5
InChI InChI=1S/C19H24O5/c1-14(18(24-15(2)20)10-12-19(3,4)21)11-13-23-17-8-6-16(22-5)7-9-17/h6-9,11,18,21H,13H2,1-5H3/b14-11+
InChIKey QDNMJRLBKLAKKX-SDNWHVSQSA-N
Molecular Weight 332.396 g/mol
SMILES C(#CC(O)(C)C)C(\C(=C\COC=1C=CC(=CC1)OC)C)OC(=O)C