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Crotamiton-M (HOOC-) (trans) TMS
SpectraBase Compound ID KGBIcu5H9VC
InChI InChI=1S/C16H23NO3Si/c1-6-17(14-10-8-7-9-13(14)2)15(18)11-12-16(19)20-21(3,4)5/h7-12H,6H2,1-5H3/b12-11+
InChIKey SCCUMIPCZVXNBW-VAWYXSNFSA-N
Mol Weight 305.45 g/mol
Molecular Formula C16H23NO3Si
Exact Mass 305.14472 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Phk9KJdr6
Name Crotamiton-M (HOOC-) (trans) TMS
Classification Scabicide
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Exact Mass 305.144720137 u
Formula C16H23NO3Si
InChI InChI=1S/C16H23NO3Si/c1-6-17(14-10-8-7-9-13(14)2)15(18)11-12-16(19)20-21(3,4)5/h7-12H,6H2,1-5H3/b12-11+
InChIKey SCCUMIPCZVXNBW-VAWYXSNFSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 305.449 g/mol
SMILES c1ccc(N(C(\C=C\C(O[Si](C)(C)C)=O)=O)CC)c(C)c1
SPLASH splash10-00el-7920000000-3af910f859002a660173
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: UTMS
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_5349