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bis(2-Hydroxyethyl) phthalate, acetate

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

bis(2-Hydroxyethyl) phthalate, acetate
SpectraBase Compound ID LUPAWfNbqKz
InChI InChI=1S/C14H16O7/c1-10(16)19-8-9-21-14(18)12-5-3-2-4-11(12)13(17)20-7-6-15/h2-5,15H,6-9H2,1H3
InChIKey GSLIUECNXAIMFK-UHFFFAOYSA-N
Mol Weight 296.28 g/mol
Molecular Formula C14H16O7
Exact Mass 296.089603 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1qeScpEZonO
Name bis(2-Hydroxyethyl) phthalate, acetate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 296.089602848 u
Formula C14H16O7
InChI InChI=1S/C14H16O7/c1-10(16)19-8-9-21-14(18)12-5-3-2-4-11(12)13(17)20-7-6-15/h2-5,15H,6-9H2,1H3
InChIKey GSLIUECNXAIMFK-UHFFFAOYSA-N
Molecular Weight 296.275 g/mol
SMILES C(OC(=O)C1=C(C=CC=C1)C(=O)OCCO)COC(C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.895392