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Mefruside

View entire compound with spectra: 3 MS (GC)

Mefruside
SpectraBase Compound ID LfVa40h2j3
InChI InChI=1S/C13H19ClN2O5S2/c1-13(6-3-7-21-13)9-16(2)23(19,20)10-4-5-11(14)12(8-10)22(15,17)18/h4-5,8H,3,6-7,9H2,1-2H3,(H2,15,17,18)
InChIKey SMNOERSLNYGGOU-UHFFFAOYSA-N
Mol Weight 382.88 g/mol
Molecular Formula C13H19ClN2O5S2
Exact Mass 382.042392 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3GIeuFoAMFo
Name Mefruside
Alternate Name(s) 1,3-Benzenedisulfonamide, 4-chloro-N(1)-methyl-N(1)-[(tetrahydro-2-methyl-2-furanyl)methyl]- 1,3-Benzenedisulfonamide, 4-chloro-n(sup 1)-methyl-n(sup 1)-((tetrahydro-2-methyl-2-furanyl)methyl)- 4-Chloranyl-N1-methyl-N1-[(2-methyloxolan-2-yl)methyl]benzene-1,3-disulfonamide 4-Chloro-1-N-methyl-1-N-[(2-methyloxolan-2-yl)methyl]benzene-1,3-disulfonamide 4-Chloro-n(sup 1)-methyl-n(sup 1)-(tetrahydro-2-methylfurfuryl)-m-benzenedisulfonamide 4-Chloro-N-methyl-N-(2-methyltetrahydrofurfuryl)-1,3-benzenesulfonamide 4-Chloro-N-methyl-N-[(2-methyltetrahydrofuran-2-yl)methyl]benzene-1,3-disulfonamide 4-Chloro-N1-methyl-N1-(tetrahydro-2-methylfurfuryl)-m-benzenedisulfonamide 4-Chloro-N1-methyl-N1-[(2-methyl-2-oxolanyl)methyl]benzene-1,3-disulfonamide 4-Chloro-N1-methyl-N1-[(2-methyltetrahydrofuran-2-yl)methyl]benzene-1,3-disulfonamide Baycaron M-benzenedisulfonamide, 4-chloro-n(sup 1)-methyl-n(sup 1)-(tetrahydro-2-methylfurfuryl)- m-Benzenedisulfonamide, 4-chloro-N1-methyl-N1-(tetrahydro-2-methylfurfuryl)- Mefrusal Mefrusid Mefrusida Mefrusidum N-(4'-Chloro-3'-sulfamoylbenzenesulfonyl)-N-methyl-2-aminomethyl-2-methyltetrahydrofuran B 1500 BAY 1500 EINECS 230-562-4 FBA 1500 FDA 1902
CAS Registry Number 7195-27-9
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Formula C13H19ClN2O5S2
InChI InChI=1S/C13H19ClN2O5S2/c1-13(6-3-7-21-13)9-16(2)23(19,20)10-4-5-11(14)12(8-10)22(15,17)18/h4-5,8H,3,6-7,9H2,1-2H3,(H2,15,17,18)
InChIKey SMNOERSLNYGGOU-UHFFFAOYSA-N
Molecular Weight 382.877 g/mol
SMILES NS(c1cc(S(N(CC2(OCCC2)C)C)(=O)=O)ccc1Cl)(=O)=O
SPLASH splash10-000i-9000000000-2a9d49cf3213d8f89d06
Source of Spectrum JZ-1992-1747-0
Wiley ID 1360349