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acetamide, 2-[[1-(1,3-benzodioxol-5-yl)-1H-tetrazol-5-yl]thio]-N-(3,4-difluorophenyl)-
SpectraBase Compound ID 4Tmsn6YA6T2
InChI InChI=1S/C16H11F2N5O3S/c17-11-3-1-9(5-12(11)18)19-15(24)7-27-16-20-21-22-23(16)10-2-4-13-14(6-10)26-8-25-13/h1-6H,7-8H2,(H,19,24)
InChIKey IIKWXCJFDZMGNN-UHFFFAOYSA-N
Mol Weight 391.35 g/mol
Molecular Formula C16H11F2N5O3S
Exact Mass 391.055067 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3P3M6dGjqUj
Name acetamide, 2-[[1-(1,3-benzodioxol-5-yl)-1H-tetrazol-5-yl]thio]-N-(3,4-difluorophenyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 391.055066731 u
Formula C16H11F2N5O3S
InChI InChI=1S/C16H11F2N5O3S/c17-11-3-1-9(5-12(11)18)19-15(24)7-27-16-20-21-22-23(16)10-2-4-13-14(6-10)26-8-25-13/h1-6H,7-8H2,(H,19,24)
InChIKey IIKWXCJFDZMGNN-UHFFFAOYSA-N
Molecular Weight 391.353 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_7319
Solvent DMSO-d6
Source Vendor ID: NMR/10222852; Lab Info: SAD; Lab Number: SAD-DAS1474
Temperature 23.85 °C