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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 GYWAj5dNQ7o
Name MEFRUSIDE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
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
Instrument Name GC
Molecular Weight 382.877 g/mol
SMILES c1(cc(S(N(CC2(OCCC2)C)C)(=O)=O)ccc1Cl)S(N)(=O)=O
SPLASH splash10-000i-9000000000-f5da060381e7ced6830b
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany