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1-(3,5-di-Tert-butyl-4-hydroxyphenyl)-2-bromethanone

View entire compound with spectra: 1 NMR, and 1 FTIR

1-(3,5-di-Tert-butyl-4-hydroxyphenyl)-2-bromethanone
SpectraBase Compound ID 9DPJZfp1Qml
InChI InChI=1S/C16H23BrO2/c1-15(2,3)11-7-10(13(18)9-17)8-12(14(11)19)16(4,5)6/h7-8,19H,9H2,1-6H3
InChIKey UYPXQSLSPUBZQW-UHFFFAOYSA-N
Mol Weight 327.26 g/mol
Molecular Formula C16H23BrO2
Exact Mass 326.088143 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3MHhdH1BDf0
Name 1-(3,5-di-Tert-butyl-4-hydroxyphenyl)-2-bromethanone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 326.088142979 u
Formula C16H23BrO2
InChI InChI=1S/C16H23BrO2/c1-15(2,3)11-7-10(13(18)9-17)8-12(14(11)19)16(4,5)6/h7-8,19H,9H2,1-6H3
InChIKey UYPXQSLSPUBZQW-UHFFFAOYSA-N
Molecular Weight 327.262 g/mol
SMILES C(Br)C(=O)C1=CC(C(C)(C)C)=C(O)C(C(C)(C)C)=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.980719