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2'-Bromo-5-tert-butyl-2-methoxybenzophenone

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 Raman

2'-Bromo-5-tert-butyl-2-methoxybenzophenone
SpectraBase Compound ID 4mgYqthiYCi
InChI InChI=1S/C18H19BrO2/c1-18(2,3)12-9-10-16(21-4)14(11-12)17(20)13-7-5-6-8-15(13)19/h5-11H,1-4H3
InChIKey UIPUIPJQHRCUAD-UHFFFAOYSA-N
Mol Weight 347.25 g/mol
Molecular Formula C18H19BrO2
Exact Mass 346.056843 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID C2clh01D4Ov
Name 2'-Bromo-5-tert-butyl-2-methoxybenzophenone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 346.056842850 u
Formula C18H19BrO2
InChI InChI=1S/C18H19BrO2/c1-18(2,3)12-9-10-16(21-4)14(11-12)17(20)13-7-5-6-8-15(13)19/h5-11H,1-4H3
InChIKey UIPUIPJQHRCUAD-UHFFFAOYSA-N
Molecular Weight 347.252 g/mol
SMILES C1=C(C(=CC(=C1)C(C)(C)C)C(C=1C=CC=CC1Br)=O)OC
Spectrum/Structure Validation Score (Raman) 0.792804