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2-Chloro-4-methylphenol, o-(N-propyloxycarbonyl)-

View entire compound with spectra: 1 FTIR

2-Chloro-4-methylphenol, o-(N-propyloxycarbonyl)-
SpectraBase Compound ID AZDTonjWN6U
InChI InChI=1S/C11H13ClO3/c1-3-6-14-11(13)15-10-5-4-8(2)7-9(10)12/h4-5,7H,3,6H2,1-2H3
InChIKey HTGZNFBWGKMJLV-UHFFFAOYSA-N
Mol Weight 228.67 g/mol
Molecular Formula C11H13ClO3
Exact Mass 228.055322 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6mIIH0FUcWv
Name 2-Chloro-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 228.055321976 u
Formula C11H13ClO3
InChI InChI=1S/C11H13ClO3/c1-3-6-14-11(13)15-10-5-4-8(2)7-9(10)12/h4-5,7H,3,6H2,1-2H3
InChIKey HTGZNFBWGKMJLV-UHFFFAOYSA-N
Molecular Weight 228.675 g/mol
SMILES C1(Cl)=C(OC(OCCC)=O)C=CC(=C1)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.891965