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(2R,3S)-3-[1-(Benzyloxy)-2-butoxy]-2-hydroxybutyl tosylate

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

(2R,3S)-3-[1-(Benzyloxy)-2-butoxy]-2-hydroxybutyl tosylate
SpectraBase Compound ID HHHkc43dGvi
InChI InChI=1S/C22H30O6S/c1-4-20(15-26-14-19-8-6-5-7-9-19)28-18(3)22(23)16-27-29(24,25)21-12-10-17(2)11-13-21/h5-13,18,20,22-23H,4,14-16H2,1-3H3/t18-,20?,22+/m0/s1
InChIKey YIEWNAQKDUQVSJ-VRTQEHCBSA-N
Mol Weight 422.54 g/mol
Molecular Formula C22H30O6S
Exact Mass 422.17631 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5z8D4HHavt7
Name (2R,3S)-3-[1-(Benzyloxy)-2-butoxy]-2-hydroxybutyl tosylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 422.176309854 u
Formula C22H30O6S
InChI InChI=1S/C22H30O6S/c1-4-20(15-26-14-19-8-6-5-7-9-19)28-18(3)22(23)16-27-29(24,25)21-12-10-17(2)11-13-21/h5-13,18,20,22-23H,4,14-16H2,1-3H3/t18-,20?,22+/m0/s1
InChIKey YIEWNAQKDUQVSJ-VRTQEHCBSA-N
Molecular Weight 422.536 g/mol
SMILES C(OS(C1=CC=C(C=C1)C)(=O)=O)[C@]([C@@](OC(COCC1=CC=CC=C1)CC)(C)[H])(O)[H]