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(3S*,4R*,5S*)-3-Hydroxy-4-[(Z)-2-nonenyl]-5-[(E)-1-octenyl]tetrahydro-2-furanone
SpectraBase Compound ID BTNr3N5wjAG
InChI InChI=1S/C21H36O3/c1-3-5-7-9-11-12-14-16-18-19(24-21(23)20(18)22)17-15-13-10-8-6-4-2/h12,14-15,17-20,22H,3-11,13,16H2,1-2H3/b14-12-,17-15+/t18-,19-,20-/m0/s1
InChIKey NFCPTXYBXSKODT-IIKCVFORSA-N
Mol Weight 336.5 g/mol
Molecular Formula C21H36O3
Exact Mass 336.266445 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 31kgEbBcBWf
Name (3S*,4R*,5S*)-3-Hydroxy-4-[(Z)-2-nonenyl]-5-[(E)-1-octenyl]tetrahydro-2-furanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H36O3
InChI InChI=1S/C21H36O3/c1-3-5-7-9-11-12-14-16-18-19(24-21(23)20(18)22)17-15-13-10-8-6-4-2/h12,14-15,17-20,22H,3-11,13,16H2,1-2H3/b14-12-,17-15+/t18-,19-,20-/m0/s1
InChIKey NFCPTXYBXSKODT-IIKCVFORSA-N
Molecular Weight 336.516 g/mol
SMILES O[C@@]1(C(O[C@@](\C=C\CCCCCC)([C@@]1(C\C=C/CCCCCC)[H])[H])=O)[H]
SPLASH splash10-0a4i-9020000000-7d3ff554b0ab53411f46
Source of Spectrum F-66-8471-12a
Wiley ID 1684804