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Mesulphen-M (di-HO-) 2AC
SpectraBase Compound ID AH99tcAU0dv
InChI InChI=1S/C18H16O4S2/c1-11(19)21-9-13-3-5-15-17(7-13)23-16-6-4-14(8-18(16)24-15)10-22-12(2)20/h3-8H,9-10H2,1-2H3
InChIKey YXXJNUHWECHEBB-UHFFFAOYSA-N
Mol Weight 360.44 g/mol
Molecular Formula C18H16O4S2
Exact Mass 360.049001 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FcJUgm87PiK
Name Mesulphen-M (di-HO-) 2AC
Classification Scabicide
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Exact Mass 360.049001339 u
Formula C18H16O4S2
InChI InChI=1S/C18H16O4S2/c1-11(19)21-9-13-3-5-15-17(7-13)23-16-6-4-14(8-18(16)24-15)10-22-12(2)20/h3-8H,9-10H2,1-2H3
InChIKey YXXJNUHWECHEBB-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 360.442 g/mol
SMILES CC(OCc1ccc2c(Sc3c(S2)cc(COC(=O)C)cc3)c1)=O
SPLASH splash10-06vi-0394000000-ddd97426688ade598653
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Sample Preparation Procedure Detected: UGLUCAC
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_5387