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1-Chloro-3-iodo-2-methyl-1-phenylpropane
SpectraBase Compound ID J1GPrb0XYN1
InChI InChI=1S/C10H12ClI/c1-8(7-12)10(11)9-5-3-2-4-6-9/h2-6,8,10H,7H2,1H3
InChIKey VJJYDZJUYCZIQV-UHFFFAOYSA-N
Mol Weight 294.56 g/mol
Molecular Formula C10H12ClI
Exact Mass 293.967223 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FIXofz0bLoT
Name Benzene, (1-chloro-3-iodo-2-methylpropyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 293.967223086 u
Formula C10H12ClI
InChI InChI=1S/C10H12ClI/c1-8(7-12)10(11)9-5-3-2-4-6-9/h2-6,8,10H,7H2,1H3
InChIKey VJJYDZJUYCZIQV-UHFFFAOYSA-N
Molecular Weight 294.563 g/mol
SMILES C1=CC=CC(=C1)C(C(CI)C)Cl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.927705