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(2S)-3-[(1Z,5Z)-16-hydroxyhexadeca-1,5-dien-3-ynoxy]propane-1,2-diol
SpectraBase Compound ID 1J7uWLVNYs
InChI InChI=1S/C19H32O4/c20-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-23-18-19(22)17-21/h6,8,14,16,19-22H,1-5,7,9,11,13,15,17-18H2/b8-6-,16-14-/t19-/m0/s1
InChIKey PWEKCZHKMCHXSQ-MKWQSKJTSA-N
Mol Weight 324.5 g/mol
Molecular Formula C19H32O4
Exact Mass 324.23006 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1nbhbxWxE7l
Name (2S)-3-[(1Z,5Z)-16-Hydroxyhexadeca-1,5-dien-3-ynoxy]propane-1,2-diol
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 324.230059506 u
Formula C19H32O4
InChI InChI=1S/C19H32O4/c20-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-23-18-19(22)17-21/h6,8,14,16,19-22H,1-5,7,9,11,13,15,17-18H2/b8-6-,16-14-/t19-/m0/s1
InChIKey PWEKCZHKMCHXSQ-MKWQSKJTSA-N
Molecular Weight 324.461 g/mol
SMILES C(#C\C=C/CCCCCCCCCCO)\C=C/OC[C@@](O)(CO)[H]