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[5-(3-Chlorophenyl)-6-oxidanylidene-2,3-dihydropyran-2-yl]methyl ethanoate

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

[5-(3-Chlorophenyl)-6-oxidanylidene-2,3-dihydropyran-2-yl]methyl ethanoate
SpectraBase Compound ID 8mpScsKd8OE
InChI InChI=1S/C14H13ClO4/c1-9(16)18-8-12-5-6-13(14(17)19-12)10-3-2-4-11(15)7-10/h2-4,6-7,12H,5,8H2,1H3
InChIKey WHVUHFGTAMQWAW-UHFFFAOYSA-N
Mol Weight 280.71 g/mol
Molecular Formula C14H13ClO4
Exact Mass 280.050237 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID KeRc5oB0q5W
Name [5-(3-Chlorophenyl)-6-oxidanylidene-2,3-dihydropyran-2-yl]methyl ethanoate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 280.050236595 u
Formula C14H13ClO4
InChI InChI=1S/C14H13ClO4/c1-9(16)18-8-12-5-6-13(14(17)19-12)10-3-2-4-11(15)7-10/h2-4,6-7,12H,5,8H2,1H3
InChIKey WHVUHFGTAMQWAW-UHFFFAOYSA-N
SMILES C1(C(=CCC(O1)COC(=O)C)C=1C=C(Cl)C=CC1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.971177