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Di-3-indolyl-2-(5-iodoethienyl)methane
SpectraBase Compound ID 12CmjMZPN7E
InChI InChI=1S/C21H15IN2S/c22-20-10-9-19(25-20)21-16(15-6-2-4-8-18(15)24-21)11-13-12-23-17-7-3-1-5-14(13)17/h1-10,12,23-24H,11H2
InChIKey QPVJMAJYGCOFQT-UHFFFAOYSA-N
Mol Weight 454.33 g/mol
Molecular Formula C21H15IN2S
Exact Mass 454.000065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2psaFWWVUkH
Name Di-3-indolyl-2-(5-iodoethienyl)methane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H15IN2S
InChI InChI=1S/C21H15IN2S/c22-20-10-9-19(25-20)21-16(15-6-2-4-8-18(15)24-21)11-13-12-23-17-7-3-1-5-14(13)17/h1-10,12,23-24H,11H2
InChIKey QPVJMAJYGCOFQT-UHFFFAOYSA-N
Molecular Weight 454.329 g/mol
SMILES [nH]1c2c(c(Cc3c([nH]c4ccccc34)-c3sc(I)cc3)c1)cccc2
SPLASH splash10-014i-0901000000-87a09b62ac958455cf94
Source of Spectrum F-47-9229-3
Synonyms 3-(1H-indol-3-ylmethyl)-2-(5-iodo-2-thienyl)-1H-indole
Wiley ID 1388689