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5-Iodo-1H-indole
SpectraBase Compound ID 7bTikTxZ2mD
InChI InChI=1S/C8H6IN/c9-7-1-2-8-6(5-7)3-4-10-8/h1-5,10H
InChIKey TVQLYTUWUQMGMP-UHFFFAOYSA-N
Mol Weight 243.05 g/mol
Molecular Formula C8H6IN
Exact Mass 242.954494 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8JRYZdiJJFA
Name 5-Iodoindole
CAS Registry Number 16066-91-4
Classification Pharmaceutical drug intermediate
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 242.954494197 u
Formula C8H6IN
InChI InChI=1S/C8H6IN/c9-7-1-2-8-6(5-7)3-4-10-8/h1-5,10H
InChIKey TVQLYTUWUQMGMP-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 243.047 g/mol
Nominal Mass 243 u
Quality 991
Retention Index 1599
SMILES C=12C(NC=C2)=CC=C(C1)I
SPLASH splash10-0006-8690000000-868a99ffa371878c568f
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Indole,5-iodo 5-Iodo-1H-indole
Technique GC/MS
Wiley ID DD2024_017469