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(3-Chlorophenoxy)acetaldehyde diethyl acetal

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

(3-Chlorophenoxy)acetaldehyde diethyl acetal
SpectraBase Compound ID HjxAUlt4RT8
InChI InChI=1S/C12H17ClO3/c1-3-14-12(15-4-2)9-16-11-7-5-6-10(13)8-11/h5-8,12H,3-4,9H2,1-2H3
InChIKey GQSAPJZWLBMQFN-UHFFFAOYSA-N
Mol Weight 244.72 g/mol
Molecular Formula C12H17ClO3
Exact Mass 244.086622 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID H0BDPTphICI
Name (3-Chlorophenoxy)acetaldehyde diethyl acetal
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 244.086622104 u
Formula C12H17ClO3
InChI InChI=1S/C12H17ClO3/c1-3-14-12(15-4-2)9-16-11-7-5-6-10(13)8-11/h5-8,12H,3-4,9H2,1-2H3
InChIKey GQSAPJZWLBMQFN-UHFFFAOYSA-N
Molecular Weight 244.718 g/mol
SMILES C(COC=1C=C(C=CC1)Cl)(OCC)OCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.900252