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Chlorthalidone 3ME
SpectraBase Compound ID GYkzA3zlY7L
InChI InChI=1S/C17H17ClN2O4S/c1-19(2)25(23,24)15-10-11(8-9-14(15)18)17(22)13-7-5-4-6-12(13)16(21)20(17)3/h4-10,22H,1-3H3
InChIKey ACCFSOGJYLBKDC-UHFFFAOYSA-N
Mol Weight 380.85 g/mol
Molecular Formula C17H17ClN2O4S
Exact Mass 380.059756 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID pd0sv3onY
Name Chlortalidone 3ME
Classification Diuretic
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Exact Mass 380.059755905 u
Formula C17H17ClN2O4S
InChI InChI=1S/C17H17ClN2O4S/c1-19(2)25(23,24)15-10-11(8-9-14(15)18)17(22)13-7-5-4-6-12(13)16(21)20(17)3/h4-10,22H,1-3H3
InChIKey ACCFSOGJYLBKDC-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 380.846 g/mol
Related CAS Registry Number(s) 77-36-1
SMILES C1(c2ccccc2C(c2ccc(c(c2)S(=O)(=O)N(C)C)Cl)(N1C)O)=O
SPLASH splash10-0f6t-0119000000-e3488adfeb87875b6e4c
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_3103