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[2-Bromo-5-(trifluoromethoxy)phenyl]methanol, acetate

View entire compound with spectra: 1 FTIR

[2-Bromo-5-(trifluoromethoxy)phenyl]methanol, acetate
SpectraBase Compound ID BtuxrHbv6rg
InChI InChI=1S/C10H8BrF3O3/c1-6(15)16-5-7-4-8(2-3-9(7)11)17-10(12,13)14/h2-4H,5H2,1H3
InChIKey NXJRURGHPQZFPU-UHFFFAOYSA-N
Mol Weight 313.07 g/mol
Molecular Formula C10H8BrF3O3
Exact Mass 311.960892 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 20M5IiI4Hvd
Name [2-Bromo-5-(trifluoromethoxy)phenyl]methanol, acetate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 311.960891604 u
Formula C10H8BrF3O3
InChI InChI=1S/C10H8BrF3O3/c1-6(15)16-5-7-4-8(2-3-9(7)11)17-10(12,13)14/h2-4H,5H2,1H3
InChIKey NXJRURGHPQZFPU-UHFFFAOYSA-N
Molecular Weight 313.070 g/mol
SMILES C(OC1=CC(COC(C)=O)=C(C=C1)Br)(F)(F)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.9017