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Thiocyclam
SpectraBase Compound ID H2MrOEjwzur
InChI InChI=1S/C5H11NS3/c1-6(2)5-3-7-9-8-4-5/h5H,3-4H2,1-2H3
InChIKey DNVLJEWNNDHELH-UHFFFAOYSA-N
Mol Weight 181.33 g/mol
Molecular Formula C5H11NS3
Exact Mass 181.005363 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID V38SZcLuS
Name Thiocyclam
CAS Registry Number 31895-21-3
Classification Insecticide
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 181.005362880 u
Formula C5H11NS3
InChI InChI=1S/C5H11NS3/c1-6(2)5-3-7-9-8-4-5/h5H,3-4H2,1-2H3
InChIKey DNVLJEWNNDHELH-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 181.330 g/mol
SMILES CN(C1CSSSC1)C
SPLASH splash10-00di-9200000000-b370a02bbfbb57438f4e
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.
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_4083