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alpha-(amidinothio)-m-toluic acid, monohydrochloride

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alpha-(amidinothio)-m-toluic acid, monohydrochloride
SpectraBase Compound ID FtqaNolMncA
InChI InChI=1S/C9H10N2O2S.ClH/c10-9(11)14-5-6-2-1-3-7(4-6)8(12)13;/h1-4H,5H2,(H3,10,11)(H,12,13);1H
InChIKey KGEQHJKUBAWBBW-UHFFFAOYSA-N
Mol Weight 246.71 g/mol
Molecular Formula C9H11ClN2O2S
Exact Mass 246.022976 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8U9y3pxr0PY
Name alpha-(AMIDINOTHIO)-m-TOLUIC ACID, MONOHYDROCHLORIDE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10N2O2S HCl
InChI InChI=1S/C9H10N2O2S.ClH/c10-9(11)14-5-6-2-1-3-7(4-6)8(12)13;/h1-4H,5H2,(H3,10,11)(H,12,13);1H
InChIKey KGEQHJKUBAWBBW-UHFFFAOYSA-N
Melting Point 234C
Molecular Weight 246.72
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms M-TOLUIC ACID, A-/AMIDINOTHIO/-, MONOHYDROCHLORIDE