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3-Benzyloxy-1-propanal diethyl acetal

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

3-Benzyloxy-1-propanal diethyl acetal
SpectraBase Compound ID 3VtqqkQ2b7X
InChI InChI=1S/C14H22O3/c1-3-16-14(17-4-2)10-11-15-12-13-8-6-5-7-9-13/h5-9,14H,3-4,10-12H2,1-2H3
InChIKey KCZYOZAICVAYMO-UHFFFAOYSA-N
Mol Weight 238.33 g/mol
Molecular Formula C14H22O3
Exact Mass 238.156895 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID nYQ6NEe8Mk
Name 3-Benzyloxy-1-propanal diethyl acetal
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 238.156894565 u
Formula C14H22O3
InChI InChI=1S/C14H22O3/c1-3-16-14(17-4-2)10-11-15-12-13-8-6-5-7-9-13/h5-9,14H,3-4,10-12H2,1-2H3
InChIKey KCZYOZAICVAYMO-UHFFFAOYSA-N
Molecular Weight 238.327 g/mol
SMILES C(C(OCC)OCC)COCC=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.967741