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dl-Glyceraldehyde, di(heptafluorobutyrate)

View entire compound with spectra: 1 FTIR

dl-Glyceraldehyde, di(heptafluorobutyrate)
SpectraBase Compound ID FbCVca8c2tI
InChI InChI=1S/C11H4F14O5/c12-6(13,8(16,17)10(20,21)22)4(27)29-2-3(1-26)30-5(28)7(14,15)9(18,19)11(23,24)25/h1,3H,2H2
InChIKey JWSAWJKRYBSBHF-UHFFFAOYSA-N
Mol Weight 482.13 g/mol
Molecular Formula C11H4F14O5
Exact Mass 481.983518 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID H0y1HDIDptR
Name dl-Glyceraldehyde, di(heptafluorobutyrate)
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 481.983517506 u
Formula C11H4F14O5
InChI InChI=1S/C11H4F14O5/c12-6(13,8(16,17)10(20,21)22)4(27)29-2-3(1-26)30-5(28)7(14,15)9(18,19)11(23,24)25/h1,3H,2H2
InChIKey JWSAWJKRYBSBHF-UHFFFAOYSA-N
Molecular Weight 482.126 g/mol
SMILES C(OC(=O)C(C(C(F)(F)F)(F)F)(F)F)(COC(=O)C(C(C(F)(F)F)(F)F)(F)F)C=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.934401