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Benzyl N-(cyclopentyloxycarbonyl)dithioglycine
SpectraBase Compound ID LYUHqxG1uOS
InChI InChI=1S/C15H19NO2S2/c17-15(18-13-8-4-5-9-13)16-10-14(19)20-11-12-6-2-1-3-7-12/h1-3,6-7,13H,4-5,8-11H2,(H,16,17)
InChIKey CFQXRNDAVNGAHG-UHFFFAOYSA-N
Mol Weight 309.44 g/mol
Molecular Formula C15H19NO2S2
Exact Mass 309.085721 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CJsOLFpE07g
Name Benzyl N-(cyclopentyloxycarbonyl)dithioglycine
Alternate Name(s) benzyl {[(cyclopentyloxy)carbonyl]amino}ethanedithioate
CAS Registry Number 140903-22-6
Comments Less than 3 mono-isotopic peaks
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Formula C15H19NO2S2
InChI InChI=1S/C15H19NO2S2/c17-15(18-13-8-4-5-9-13)16-10-14(19)20-11-12-6-2-1-3-7-12/h1-3,6-7,13H,4-5,8-11H2,(H,16,17)
InChIKey CFQXRNDAVNGAHG-UHFFFAOYSA-N
Molecular Weight 309.442 g/mol
SMILES N(C(OC1CCCC1)=O)CC(=S)SCc1ccccc1
SPLASH splash10-0006-9002000000-e48af1406a5f87316fa8
Source of Spectrum U-1992-600-3
Wiley ID 764112