SpectraBase Spectrum ID |
Rb8c137zXK |
Name |
Crotamiton-M ME |
Classification |
Scabicide |
Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
295.124214711 u |
Formula |
C15H21NO3S |
InChI |
InChI=1S/C15H21NO3S/c1-5-16(12-9-7-6-8-11(12)2)14(17)10-13(20-4)15(18)19-3/h6-9,13H,5,10H2,1-4H3 |
InChIKey |
SFYMONIIIGDFFW-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
295.397 g/mol |
SMILES |
C(N(c1c(C)cccc1)CC)(CC(C(=O)OC)SC)=O |
SPLASH |
splash10-01qa-3930000000-ad1b45aa4a2dca9d3492 |
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: UGLUCME |
Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
Synonyms |
Crotamiton-M (HOOC-methyl-thio-) ME |
Technique |
GC/MS |
Wiley ID |
MMPW6e_5376 |