For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Methanesulfenamide, 1,1-dichloro-1-fluoro-N-1H-purin-6-yl-
SpectraBase Compound ID GLFMP1l08Wv
InChI InChI=1S/C6H4Cl2FN5S/c7-6(8,9)15-14-5-3-4(11-1-10-3)12-2-13-5/h1-2H,(H2,10,11,12,13,14)
InChIKey PNJVSHAPRWBDEQ-UHFFFAOYSA-N
Mol Weight 268.1 g/mol
Molecular Formula C6H4Cl2FN5S
Exact Mass 266.95485 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID BzKB6J6Rgwb
Name Methanesulfenamide, 1,1-dichloro-1-fluoro-N-1H-purin-6-yl-
CAS Registry Number 55055-54-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H4Cl2FN5S
InChI InChI=1S/C6H4Cl2FN5S/c7-6(8,9)15-14-5-3-4(11-1-10-3)12-2-13-5/h1-2H,(H2,10,11,12,13,14)
InChIKey PNJVSHAPRWBDEQ-UHFFFAOYSA-N
Molecular Weight 268.097 g/mol
SMILES N1C=NC=2C(=C1NSC(F)(Cl)Cl)N=CN2
SPLASH splash10-014l-8920000000-01cdc005e191d0c55645
Source of Spectrum K-108-336-13
Synonyms 6-({[dichloro(fluoro)methyl]sulfanyl}amino)-1H-purine N6-(dichlorofluoromethylmercapto)adenine N6-(dichlorofluoromethylthio)adenine S-[dichloro(fluoro)methyl]-N-(1H-purin-6-yl)thiohydroxylamine
Wiley ID 1270838