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4-(Methoxymethyl)-2-phenyl-1,3-dioxan

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

4-(Methoxymethyl)-2-phenyl-1,3-dioxan
SpectraBase Compound ID 4rZwroddBfy
InChI InChI=1S/C12H16O3/c1-13-9-11-7-8-14-12(15-11)10-5-3-2-4-6-10/h2-6,11-12H,7-9H2,1H3
InChIKey ZHCNOBMJCVBXSB-UHFFFAOYSA-N
Mol Weight 208.26 g/mol
Molecular Formula C12H16O3
Exact Mass 208.109944 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2E5L36gOZOH
Name 4-(Methoxymethyl)-2-phenyl-1,3-dioxan
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 208.109944372 u
Formula C12H16O3
InChI InChI=1S/C12H16O3/c1-13-9-11-7-8-14-12(15-11)10-5-3-2-4-6-10/h2-6,11-12H,7-9H2,1H3
InChIKey ZHCNOBMJCVBXSB-UHFFFAOYSA-N
Molecular Weight 208.257 g/mol
SMILES C1(OCCC(O1)COC)C=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.830889