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Cycloheptatrienylium, iodide
SpectraBase Compound ID CcZ0pQeB384
InChI InChI=1S/C7H7I/c8-7-5-3-1-2-4-6-7/h1-7H
InChIKey AQWWXWSXTIHEKS-UHFFFAOYSA-N
Mol Weight 218.04 g/mol
Molecular Formula C7H7I
Exact Mass 217.959245 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FGNAxIDFAYU
Name Cycloheptatrienylium, iodide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 217.959245225 u
Formula C7H7I
InChI InChI=1S/C7H7I/c8-7-5-3-1-2-4-6-7/h1-7H
InChIKey AQWWXWSXTIHEKS-UHFFFAOYSA-N
Molecular Weight 218.037 g/mol
SMILES C=1C=CC(C=CC1)I
Spectrum/Structure Validation Score (Vapor Phase IR) 0.930317