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2-[1-(ORTHO-METHOXYCARBONYLBENZAMIDO)-1-METHOXY-1-METHOXYCARBONYLMETHYL]-4-DIMETHYLAMINO-1-THIA-3-AZABUTADIENE-1,3
SpectraBase Compound ID 6aTfGwLR2Fy
InChI InChI=1S/C17H21N3O6S/c1-20(2)10-18-15(27)17(26-5,16(23)25-4)19-13(21)11-8-6-7-9-12(11)14(22)24-3/h6-10H,1-5H3,(H,19,21)/b18-10+
InChIKey MFICXWYSXXJADC-VCHYOVAHSA-N
Mol Weight 395.43 g/mol
Molecular Formula C17H21N3O6S
Exact Mass 395.115107 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5MgK6NPcxIv
Name 2-[1-(ORTHO-METHOXYCARBONYLBENZAMIDO)-1-METHOXY-1-METHOXYCARBONYLMETHYL]-4-DIMETHYLAMINO-1-THIA-3-AZABUTADIENE-1,3
Comments 0,
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Formula C17H21N3O6S
InChI InChI=1S/C17H21N3O6S/c1-20(2)10-18-15(27)17(26-5,16(23)25-4)19-13(21)11-8-6-7-9-12(11)14(22)24-3/h6-10H,1-5H3,(H,19,21)/b18-10+
InChIKey MFICXWYSXXJADC-VCHYOVAHSA-N
Instrument Name SEE COMMENT
Literature Reference CELESTIN TEA GOKOU, MOUSTAFA CHEHNA, JEAN-PAUL PRADERE, GUY DUGUAY, LOIC TOUPET(1986) Phosphorus and Sulfur: v.27, N3, 327-339.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d