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dithio-3-(tetrahydro-3H-azepin-2yl)carbazic acid, methyl ester
SpectraBase Compound ID 69FaC4Ha0qG
InChI InChI=1S/C8H15N3S2/c1-13-8(12)11-10-7-5-3-2-4-6-9-7/h2-6H2,1H3,(H,9,10)(H,11,12)
InChIKey RXQXXGTXRWRWGF-UHFFFAOYSA-N
Mol Weight 217.35 g/mol
Molecular Formula C8H15N3S2
Exact Mass 217.07074 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7ovIFQ9OJ0q
Name dithio-3-(tetrahydro-3H-azepin-2yl)carbazic acid, methyl ester
Comments NH 's unobserved
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Formula C8H15N3S2
InChI InChI=1S/C8H15N3S2/c1-13-8(12)11-10-7-5-3-2-4-6-9-7/h2-6H2,1H3,(H,9,10)(H,11,12)
InChIKey RXQXXGTXRWRWGF-UHFFFAOYSA-N
Instrument Name Varian A-60
Sadtler NMR Number 8345M
Solvent DMSO-d6