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1-Bromanyl-2-phenylmethoxy-3,5-di(propan-2-yl)benzene
SpectraBase Compound ID LRVIcOcGeUZ
InChI InChI=1S/C19H23BrO/c1-13(2)16-10-17(14(3)4)19(18(20)11-16)21-12-15-8-6-5-7-9-15/h5-11,13-14H,12H2,1-4H3
InChIKey SCWUNHVBKQQNHV-UHFFFAOYSA-N
Mol Weight 347.3 g/mol
Molecular Formula C19H23BrO
Exact Mass 346.093228 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 51spKfTp4MI
Name 1-Bromanyl-2-phenylmethoxy-3,5-di(propan-2-yl)benzene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 346.093228360 u
Formula C19H23BrO
InChI InChI=1S/C19H23BrO/c1-13(2)16-10-17(14(3)4)19(18(20)11-16)21-12-15-8-6-5-7-9-15/h5-11,13-14H,12H2,1-4H3
InChIKey SCWUNHVBKQQNHV-UHFFFAOYSA-N
Molecular Weight 347.296 g/mol
SMILES C=1(C(=C(Br)C=C(C1)C(C)C)OCC=1C=CC=CC1)C(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.960964