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3-o-Acetyl-exo-1,2-o-ethylidene-.alpha.-D-erythrofuranose
SpectraBase Compound ID HkSNPtziIMt
InChI InChI=1S/C8H12O5/c1-4(9)11-6-3-10-8-7(6)12-5(2)13-8/h5-8H,3H2,1-2H3/t5?,6-,7-,8-/m1/s1
InChIKey UMWLXVWWLANQFN-UIYHXYAWSA-N
Mol Weight 188.18 g/mol
Molecular Formula C8H12O5
Exact Mass 188.068473 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JvvPZEhZHxa
Name 3-o-Acetyl-exo-1,2-o-ethylidene-.alpha.-D-erythrofuranose
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 188.068473481 u
Formula C8H12O5
InChI InChI=1S/C8H12O5/c1-4(9)11-6-3-10-8-7(6)12-5(2)13-8/h5-8H,3H2,1-2H3/t5?,6-,7-,8-/m1/s1
InChIKey UMWLXVWWLANQFN-UIYHXYAWSA-N
Molecular Weight 188.179 g/mol
SMILES [C@]12([C@](OC(O2)C)([C@](OC(=O)C)(CO1)[H])[H])[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.85908