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1,2-Propanediol, 1-(3,4-dimethoxyphenyl)-, diacetate

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

1,2-Propanediol, 1-(3,4-dimethoxyphenyl)-, diacetate
SpectraBase Compound ID BdX9TMfI31R
InChI InChI=1S/C15H20O6/c1-9(20-10(2)16)15(21-11(3)17)12-6-7-13(18-4)14(8-12)19-5/h6-9,15H,1-5H3
InChIKey NNZHPRGCBQMVTG-UHFFFAOYSA-N
Mol Weight 296.32 g/mol
Molecular Formula C15H20O6
Exact Mass 296.125988 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CAAPWox2YYT
Name 1,2-Propanediol, 1-(3,4-dimethoxyphenyl)-, diacetate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 296.125988358 u
Formula C15H20O6
InChI InChI=1S/C15H20O6/c1-9(20-10(2)16)15(21-11(3)17)12-6-7-13(18-4)14(8-12)19-5/h6-9,15H,1-5H3
InChIKey NNZHPRGCBQMVTG-UHFFFAOYSA-N
SMILES C=1(C(C(OC(=O)C)C)OC(=O)C)C=C(OC)C(=CC1)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.956449