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D-Mannonothionolactam
SpectraBase Compound ID KrLrvcdRZu9
InChI InChI=1S/C6H11NO4S/c8-2-1-7-6(12)5(11)4(10)3(2)9/h2-5,8-11H,1H2,(H,7,12)/t2-,3-,4+,5+/m1/s1
InChIKey CIFRXYUGJAUQJP-MBMOQRBOSA-N
Mol Weight 193.22 g/mol
Molecular Formula C6H11NO4S
Exact Mass 193.040879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JuazSCkl8SF
Name D-Mannonothionolactam
Alternate Name(s) (3S,4S,5R,6R)-3,4,5,6-tetrahydroxyhexahydro-2H-azepine-2-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H11NO4S
InChI InChI=1S/C6H11NO4S/c8-2-1-7-6(12)5(11)4(10)3(2)9/h2-5,8-11H,1H2,(H,7,12)/t2-,3-,4+,5+/m1/s1
InChIKey CIFRXYUGJAUQJP-MBMOQRBOSA-N
Molecular Weight 193.217 g/mol
SMILES O[C@]1([C@]([C@@]([C@@](C(NC1)=S)(O)[H])(O)[H])(O)[H])[H]
SPLASH splash10-052f-0900000000-18ee398b03971ac541bf
Source of Spectrum C-115-11689-34
Wiley ID 1189374