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N-{[2,5-bis(2,2,2-trifluoroethoxy)phenyl]sulfonyl}dithioimidocarbonic acid, dimethyl ester
SpectraBase Compound ID 9C9tOk0zWQK
InChI InChI=1S/C13H13F6NO4S3/c1-25-11(26-2)20-27(21,22)10-5-8(23-6-12(14,15)16)3-4-9(10)24-7-13(17,18)19/h3-5H,6-7H2,1-2H3
InChIKey RAGXBTVGRMACNR-UHFFFAOYSA-N
Mol Weight 457.42 g/mol
Molecular Formula C13H13F6NO4S3
Exact Mass 456.99109 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9QUZP38AuSm
Name N-{[2,5-bis(2,2,2-trifluoroethoxy)phenyl]sulfonyl}dithioimidocarbonic acid, dimethyl ester
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Formula C13H13F6NO4S3
InChI InChI=1S/C13H13F6NO4S3/c1-25-11(26-2)20-27(21,22)10-5-8(23-6-12(14,15)16)3-4-9(10)24-7-13(17,18)19/h3-5H,6-7H2,1-2H3
InChIKey RAGXBTVGRMACNR-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 57500M
Solvent CDCl3