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phenol, 4-chloro-2-(5-mercapto-4-methyl-4H-1,2,4-triazol-3-yl)-
SpectraBase Compound ID JWgpjgRcZ2p
InChI InChI=1S/C9H8ClN3OS/c1-13-8(11-12-9(13)15)6-4-5(10)2-3-7(6)14/h2-4,14H,1H3,(H,12,15)
InChIKey HMHGWLRIAHNQAQ-UHFFFAOYSA-N
Mol Weight 241.7 g/mol
Molecular Formula C9H8ClN3OS
Exact Mass 241.007661 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LJtYLtqtQqy
Name phenol, 4-chloro-2-(5-mercapto-4-methyl-4H-1,2,4-triazol-3-yl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 241.007660763 u
Formula C9H8ClN3OS
InChI InChI=1S/C9H8ClN3OS/c1-13-8(11-12-9(13)15)6-4-5(10)2-3-7(6)14/h2-4,14H,1H3,(H,12,15)
InChIKey HMHGWLRIAHNQAQ-UHFFFAOYSA-N
Molecular Weight 241.696 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_7580
Solvent DMSO-d6
Source Vendor ID: NMR/9312697; Lab Info: LP; Lab Number: LP-2191533