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1,5-Anhydro-L-rhamnitol triacetate

View entire compound with spectra: 1 NMR, and 1 FTIR

1,5-Anhydro-L-rhamnitol triacetate
SpectraBase Compound ID CaMvSt3fUJP
InChI InChI=1S/C12H18O7/c1-6-11(18-8(3)14)12(19-9(4)15)10(5-16-6)17-7(2)13/h6,10-12H,5H2,1-4H3
InChIKey QPTFIDGGNPUDEM-UHFFFAOYSA-N
Mol Weight 274.27 g/mol
Molecular Formula C12H18O7
Exact Mass 274.105253 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CvEVbroM2Ea
Name 1,5-Anhydro-L-rhamnitol triacetate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 274.105252913 u
Formula C12H18O7
InChI InChI=1S/C12H18O7/c1-6-11(18-8(3)14)12(19-9(4)15)10(5-16-6)17-7(2)13/h6,10-12H,5H2,1-4H3
InChIKey QPTFIDGGNPUDEM-UHFFFAOYSA-N
Molecular Weight 274.269 g/mol
SMILES C1(C(COC(C1OC(=O)C)C)OC(C)=O)OC(=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.968137