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6-[Cyano(2',4'-dichlorophenylthio}methyl]azulene
SpectraBase Compound ID 8VFmOUWU7AQ
InChI InChI=1S/C18H11Cl2NS/c19-15-8-9-17(16(20)10-15)22-18(11-21)14-6-4-12-2-1-3-13(12)5-7-14/h1-10,18H
InChIKey ALDUPBPCYUQPQF-UHFFFAOYSA-N
Mol Weight 344.26 g/mol
Molecular Formula C18H11Cl2NS
Exact Mass 342.998926 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AGLdJ12QxoT
Name 6-[Cyano(2',4'-dichlorophenylthio}methyl]azulene
Alternate Name(s) 6-Azulenyl[(2,4-dichlorophenyl)sulfanyl]acetonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H11Cl2NS
InChI InChI=1S/C18H11Cl2NS/c19-15-8-9-17(16(20)10-15)22-18(11-21)14-6-4-12-2-1-3-13(12)5-7-14/h1-10,18H
InChIKey ALDUPBPCYUQPQF-UHFFFAOYSA-N
Molecular Weight 344.259 g/mol
SMILES c12c(ccc(cc2)C(Sc2c(cc(cc2)Cl)Cl)C#N)ccc1
SPLASH splash10-014i-0902000000-8e02aa185532faaa064c
Source of Spectrum U-1994-617-6
Wiley ID 765970