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2,6-Dichloro-4-methylphenol, o-(N-propyloxycarbonyl)-

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2,6-Dichloro-4-methylphenol, o-(N-propyloxycarbonyl)-
SpectraBase Compound ID IuLhFO7rItI
InChI InChI=1S/C11H12Cl2O3/c1-3-4-15-11(14)16-10-8(12)5-7(2)6-9(10)13/h5-6H,3-4H2,1-2H3
InChIKey HVSOOZFJTCKCEX-UHFFFAOYSA-N
Mol Weight 263.12 g/mol
Molecular Formula C11H12Cl2O3
Exact Mass 262.01635 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DN31rtfiiDi
Name 2,6-Dichloro-4-methylphenol, o-(N-propyloxycarbonyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 262.016349643 u
Formula C11H12Cl2O3
InChI InChI=1S/C11H12Cl2O3/c1-3-4-15-11(14)16-10-8(12)5-7(2)6-9(10)13/h5-6H,3-4H2,1-2H3
InChIKey HVSOOZFJTCKCEX-UHFFFAOYSA-N
Molecular Weight 263.120 g/mol
SMILES C1(OC(OCCC)=O)=C(Cl)C=C(C=C1Cl)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.819511