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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 1gRriz188TI
Name THIOCYCLAM
CAS Registry Number 31895-21-3
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. 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
Molecular Weight 181.330 g/mol
Nominal Mass 181 u
Number of Peaks 43
SMILES CN(C)C1CSSSC1
SPLASH splash10-0006-9200000000-e7c948e7b67b4886d34f
Source of Spectrum Dr. Rolf Kuehnle
Synonyms N,N-dimethyl-1,2,3-trithian-5-amine N,N-dimethyl-N-(1,2,3-trithian-5-yl)amine
Technique DI/MS
Wiley ID WID_MSPA_4119