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Methyl 3-(3,4-diacetoxy-5-phenyloxolan-2-yl)-3-acetoxypropanoate
SpectraBase Compound ID 6Tx9WBCDZfE
InChI InChI=1S/C20H24O9/c1-11(21)26-15(10-16(24)25-4)18-20(28-13(3)23)19(27-12(2)22)17(29-18)14-8-6-5-7-9-14/h5-9,15,17-20H,10H2,1-4H3
InChIKey FGYVINJERYBLEN-UHFFFAOYSA-N
Mol Weight 408.4 g/mol
Molecular Formula C20H24O9
Exact Mass 408.142032 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9pP9PAk4uMv
Name Methyl 3-(3,4-diacetoxy-5-phenyloxolan-2-yl)-3-acetoxypropanoate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 408.142032344 u
Formula C20H24O9
InChI InChI=1S/C20H24O9/c1-11(21)26-15(10-16(24)25-4)18-20(28-13(3)23)19(27-12(2)22)17(29-18)14-8-6-5-7-9-14/h5-9,15,17-20H,10H2,1-4H3
InChIKey FGYVINJERYBLEN-UHFFFAOYSA-N
Molecular Weight 408.403 g/mol
SMILES COC(=O)CC(C1C(OC(C)=O)C(OC(C)=O)C(C2=CC=CC=C2)O1)OC(C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.960412