SpectraBase Spectrum ID |
HKuBDVkV66a |
Name |
Bithionol |
CAS Registry Number |
97-18-7 |
Classification |
Fungicide, acnetherapeutic, anthelmintic, chemotherapeutic |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
353.884261405 u |
Formula |
C12H6Cl4O2S |
InChI |
InChI=1S/C12H6Cl4O2S/c13-5-1-7(15)11(17)9(3-5)19-10-4-6(14)2-8(16)12(10)18/h1-4,17-18H |
InChIKey |
JFIOVJDNOJYLKP-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
356.050 g/mol |
Nominal Mass |
354 u |
Quality |
967 |
Retention Index |
2604 |
SMILES |
OC1=C(SC2=C(C(=CC(=C2)Cl)Cl)O)C=C(C=C1Cl)Cl |
SPLASH |
splash10-03di-2911000000-74bb52140cab7627143e |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
Bithionolum
Bitionol
2,2'-Thiobis(4,6-dichlorophenol) |
Technique |
GC/MS |
Wiley ID |
DD2024_012064 |