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Thiophene-2-carboxylic acid
SpectraBase Compound ID KYdRBlgnjnK
InChI InChI=1S/C5H4O2S/c6-5(7)4-2-1-3-8-4/h1-3H,(H,6,7)
InChIKey QERYCTSHXKAMIS-UHFFFAOYSA-N
Mol Weight 128.14 g/mol
Molecular Formula C5H4O2S
Exact Mass 127.993201 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HntHpq7iYRY
Name Azosemide-M @
CAS Registry Number 527-72-0
Classification Diuretic
Comments Original RI info: <1000*
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Exact Mass 127.993200541 u
Formula C5H4O2S
InChI InChI=1S/C5H4O2S/c6-5(7)4-2-1-3-8-4/h1-3H,(H,6,7)
InChIKey QERYCTSHXKAMIS-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 128.145 g/mol
SMILES c1(C(=O)O)sccc1
SPLASH splash10-03fr-1900000000-49220553a8e7ef906219
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
Synonyms Azosemide-M (thiophenecarboxylic acid) Thiophenecarboxylic acid
Technique GC/MS
Wiley ID MMPW6e_4282