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Butizide 3ME
SpectraBase Compound ID KlIqn1V3e5C
InChI InChI=1S/C14H22ClN3O4S2/c1-9(2)6-14-16-11-7-10(15)12(23(19,20)17(3)4)8-13(11)24(21,22)18(14)5/h7-9,14,16H,6H2,1-5H3
InChIKey ILDRKJHJPPQPPU-UHFFFAOYSA-N
Mol Weight 395.92 g/mol
Molecular Formula C14H22ClN3O4S2
Exact Mass 395.074026 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K8l9Pjx5gKC
Name Butizide 3ME
Classification Diuretic
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Exact Mass 395.074026244 u
Formula C14H22ClN3O4S2
InChI InChI=1S/C14H22ClN3O4S2/c1-9(2)6-14-16-11-7-10(15)12(23(19,20)17(3)4)8-13(11)24(21,22)18(14)5/h7-9,14,16H,6H2,1-5H3
InChIKey ILDRKJHJPPQPPU-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 395.920 g/mol
SMILES c1(S(=O)(=O)N(C)C)cc2c(cc1Cl)NC(N(S2(=O)=O)C)CC(C)C
SPLASH splash10-000i-0119000000-ee25e4053fcac060a273
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_3095