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3-Bromo-2-methyl-1-tosyl-2-propanol

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

3-Bromo-2-methyl-1-tosyl-2-propanol
SpectraBase Compound ID IB8kbksTx53
InChI InChI=1S/C11H15BrO3S/c1-9-3-5-10(6-4-9)16(14,15)8-11(2,13)7-12/h3-6,13H,7-8H2,1-2H3
InChIKey GPPHWOXHYCASDE-UHFFFAOYSA-N
Mol Weight 307.2 g/mol
Molecular Formula C11H15BrO3S
Exact Mass 305.992529 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID H0jE8pNdVC9
Name 3-Bromo-2-methyl-1-tosyl-2-propanol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 305.992528514 u
Formula C11H15BrO3S
InChI InChI=1S/C11H15BrO3S/c1-9-3-5-10(6-4-9)16(14,15)8-11(2,13)7-12/h3-6,13H,7-8H2,1-2H3
InChIKey GPPHWOXHYCASDE-UHFFFAOYSA-N
Molecular Weight 307.202 g/mol
SMILES C(S(C=1C=CC(=CC1)C)(=O)=O)C(O)(CBr)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.935987