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(6-Bromo-1,3-benzodioxol-5-yl)(4-chlorophenyl)methanol

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(6-Bromo-1,3-benzodioxol-5-yl)(4-chlorophenyl)methanol
SpectraBase Compound ID LAwzVCyxrVQ
InChI InChI=1S/C14H10BrClO3/c15-11-6-13-12(18-7-19-13)5-10(11)14(17)8-1-3-9(16)4-2-8/h1-6,14,17H,7H2
InChIKey VFOIYYWHDKNYPI-UHFFFAOYSA-N
Mol Weight 341.59 g/mol
Molecular Formula C14H10BrClO3
Exact Mass 339.950185 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 48ydrm4RrOl
Name (6-Bromo-1,3-benzodioxol-5-yl)(4-chlorophenyl)methanol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 339.950184879 u
Formula C14H10BrClO3
InChI InChI=1S/C14H10BrClO3/c15-11-6-13-12(18-7-19-13)5-10(11)14(17)8-1-3-9(16)4-2-8/h1-6,14,17H,7H2
InChIKey VFOIYYWHDKNYPI-UHFFFAOYSA-N
Molecular Weight 341.588 g/mol
SMILES C1(=C(C=C2C(=C1)OCO2)Br)C(C1=CC=C(C=C1)Cl)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.947928