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phenyl{4-[(1H-1,2,4-triazol-5-ylsulfanyl)methyl]phenyl}methanone
SpectraBase Compound ID 9sdeJfE12W5
InChI InChI=1S/C16H13N3OS/c20-15(13-4-2-1-3-5-13)14-8-6-12(7-9-14)10-21-16-17-11-18-19-16/h1-9,11H,10H2,(H,17,18,19)
InChIKey ANNMCVACJIJNMM-UHFFFAOYSA-N
Mol Weight 295.36 g/mol
Molecular Formula C16H13N3OS
Exact Mass 295.077933 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EU4GbxDsJHz
Name phenyl{4-[(1H-1,2,4-triazol-5-ylsulfanyl)methyl]phenyl}methanone
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 295.077933224 u
Formula C16H13N3OS
InChI InChI=1S/C16H13N3OS/c20-15(13-4-2-1-3-5-13)14-8-6-12(7-9-14)10-21-16-17-11-18-19-16/h1-9,11H,10H2,(H,17,18,19)
InChIKey ANNMCVACJIJNMM-UHFFFAOYSA-N
Molecular Weight 295.360 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_5642
Solvent DMSO-d6
Source Vendor ID: NMR/12318884
Temperature 29.85 °C