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benzoic acid, 4-[5-[[(4-methoxyphenyl)methyl]thio]-1H-tetrazol-1-yl]-
SpectraBase Compound ID CxQsmBsDNBP
InChI InChI=1S/C16H14N4O3S/c1-23-14-8-2-11(3-9-14)10-24-16-17-18-19-20(16)13-6-4-12(5-7-13)15(21)22/h2-9H,10H2,1H3,(H,21,22)
InChIKey KJUUEBYKNZHOQU-UHFFFAOYSA-N
Mol Weight 342.37 g/mol
Molecular Formula C16H14N4O3S
Exact Mass 342.078661 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JVBhmeOXUY8
Name benzoic acid, 4-[5-[[(4-methoxyphenyl)methyl]thio]-1H-tetrazol-1-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 342.078661498 u
Formula C16H14N4O3S
InChI InChI=1S/C16H14N4O3S/c1-23-14-8-2-11(3-9-14)10-24-16-17-18-19-20(16)13-6-4-12(5-7-13)15(21)22/h2-9H,10H2,1H3,(H,21,22)
InChIKey KJUUEBYKNZHOQU-UHFFFAOYSA-N
Molecular Weight 342.373 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_1839
Solvent DMSO-d6
Source Vendor ID: ZI/8169221; Lab Info: LP; Lab Number: LP-3700543
Temperature 29.85 °C