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Crotamiton-M (HO-thio-) 2AC
SpectraBase Compound ID EGFT6NusRpQ
InChI InChI=1S/C17H23NO4S/c1-5-18(16-9-7-6-8-12(16)2)17(21)10-15(23-14(4)20)11-22-13(3)19/h6-9,15H,5,10-11H2,1-4H3
InChIKey SOCKGBSZBBAAKO-UHFFFAOYSA-N
Mol Weight 337.43 g/mol
Molecular Formula C17H23NO4S
Exact Mass 337.134779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1hS02tPh7w
Name Crotamiton-M (HO-thio-) 2AC
Classification Scabicide
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Exact Mass 337.134779395 u
Formula C17H23NO4S
InChI InChI=1S/C17H23NO4S/c1-5-18(16-9-7-6-8-12(16)2)17(21)10-15(23-14(4)20)11-22-13(3)19/h6-9,15H,5,10-11H2,1-4H3
InChIKey SOCKGBSZBBAAKO-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 337.434 g/mol
SMILES C(N(c1c(C)cccc1)CC)(CC(SC(=O)C)COC(=O)C)=O
SPLASH splash10-03dj-1980000000-6dce2edf1a7b802a6450
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_5369