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1-(2',3'-o-Isopropylideneglycerol)-3-(2'',3''-o-isopropylideneglycerol)propanone

View entire compound with spectra: 1 NMR, and 1 MS (GC)

1-(2',3'-o-Isopropylideneglycerol)-3-(2'',3''-o-isopropylideneglycerol)propanone
SpectraBase Compound ID KayDclSHjNT
InChI InChI=1S/C15H26O7/c1-14(2)19-9-12(21-14)7-17-5-11(16)6-18-8-13-10-20-15(3,4)22-13/h12-13H,5-10H2,1-4H3
InChIKey LOKOSAQDWCFZGS-UHFFFAOYSA-N
Mol Weight 318.37 g/mol
Molecular Formula C15H26O7
Exact Mass 318.167853 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JVljO3lGxgI
Name 1-(2',3'-o-Isopropylideneglycerol)-3-(2'',3''-o-isopropylideneglycerol)propanone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 318.167853170 u
Formula C15H26O7
InChI InChI=1S/C15H26O7/c1-14(2)19-9-12(21-14)7-17-5-11(16)6-18-8-13-10-20-15(3,4)22-13/h12-13H,5-10H2,1-4H3
InChIKey LOKOSAQDWCFZGS-UHFFFAOYSA-N
Molecular Weight 318.366 g/mol
SMILES C1(OC(COCC(=O)COCC2OC(C)(C)OC2)CO1)(C)C