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5,6-o-Isopropylidene-3-o-tetradecyl-L-ascorbic acid

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

5,6-o-Isopropylidene-3-o-tetradecyl-L-ascorbic acid
SpectraBase Compound ID CGRoxqVxx8y
InChI InChI=1S/C23H40O6/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-26-21-19(24)22(25)28-20(21)18-17-27-23(2,3)29-18/h18,20,24H,4-17H2,1-3H3
InChIKey SCNOAHQUDZGVAX-UHFFFAOYSA-N
Mol Weight 412.6 g/mol
Molecular Formula C23H40O6
Exact Mass 412.282489 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1W98E1RYYnE
Name 5,6-o-Isopropylidene-3-o-tetradecyl-L-ascorbic acid
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 412.282489002 u
Formula C23H40O6
InChI InChI=1S/C23H40O6/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-26-21-19(24)22(25)28-20(21)18-17-27-23(2,3)29-18/h18,20,24H,4-17H2,1-3H3
InChIKey SCNOAHQUDZGVAX-UHFFFAOYSA-N
Molecular Weight 412.567 g/mol
SMILES C1(=C(C(C2OC(C)(C)OC2)OC1=O)OCCCCCCCCCCCCCC)O