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2-Chloro-N-(1-(4-hydroxy-2,5-dimethylphenyl)-2-methylpropan-2-yl)acetamide
SpectraBase Compound ID LZ9buIdK7K6
InChI InChI=1S/C14H20ClNO2/c1-9-6-12(17)10(2)5-11(9)7-14(3,4)16-13(18)8-15/h5-6,17H,7-8H2,1-4H3,(H,16,18)
InChIKey RORLXXPUJHGDCK-UHFFFAOYSA-N
Mol Weight 269.77 g/mol
Molecular Formula C14H20ClNO2
Exact Mass 269.118257 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FVhoRovnUYW
Name 2-Chloro-N-[1-(4-hydroxy-2,5-dimethylphenyl)-2-methylpropan-2-yl]acetamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 269.118256586 u
Formula C14H20ClNO2
InChI InChI=1S/C14H20ClNO2/c1-9-6-12(17)10(2)5-11(9)7-14(3,4)16-13(18)8-15/h5-6,17H,7-8H2,1-4H3,(H,16,18)
InChIKey RORLXXPUJHGDCK-UHFFFAOYSA-N
SMILES C=1(C=C(C)C(=CC1C)O)CC(NC(=O)CCl)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.836426