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Hydrochlorothiazide 4ME
SpectraBase Compound ID KhLOV06Mfdf
InChI InChI=1S/C11H16ClN3O4S2/c1-13(2)20(16,17)10-6-11-9(5-8(10)12)14(3)7-15(4)21(11,18)19/h5-6H,7H2,1-4H3
InChIKey QPVCMENCMBSJLZ-UHFFFAOYSA-N
Mol Weight 353.84 g/mol
Molecular Formula C11H16ClN3O4S2
Exact Mass 353.027076 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AubFbUDgTLN
Name Hydrochlorothiazide 4ME
CAS Registry Number 55670-20-7
Classification Diuretic
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Exact Mass 353.027076051 u
Formula C11H16ClN3O4S2
InChI InChI=1S/C11H16ClN3O4S2/c1-13(2)20(16,17)10-6-11-9(5-8(10)12)14(3)7-15(4)21(11,18)19/h5-6H,7H2,1-4H3
InChIKey QPVCMENCMBSJLZ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 353.839 g/mol
SMILES c1(c(cc2c(c1)N(CN(S2(=O)=O)C)C)S(=O)(=O)N(C)C)Cl
SPLASH splash10-0w2i-3898000000-7dc135f491c7b5db7eb9
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.
Sample Preparation Procedure Detected: UME
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_6536