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N-(3-chloro-4-fluorophenyl)-N'-(6-methyl-2-pyridinyl)thiourea
SpectraBase Compound ID IIKB2bnFggk
InChI InChI=1S/C13H11ClFN3S/c1-8-3-2-4-12(16-8)18-13(19)17-9-5-6-11(15)10(14)7-9/h2-7H,1H3,(H2,16,17,18,19)
InChIKey AGSKYOXORIFCTE-UHFFFAOYSA-N
Mol Weight 295.76 g/mol
Molecular Formula C13H11ClFN3S
Exact Mass 295.034624 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BMKDfWcmBBi
Name thiourea, N-(3-chloro-4-fluorophenyl)-N'-(6-methyl-2-pyridinyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 295.034624403 u
Formula C13H11ClFN3S
InChI InChI=1S/C13H11ClFN3S/c1-8-3-2-4-12(16-8)18-13(19)17-9-5-6-11(15)10(14)7-9/h2-7H,1H3,(H2,16,17,18,19)
InChIKey AGSKYOXORIFCTE-UHFFFAOYSA-N
Molecular Weight 295.763 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_5657
Solvent DMSO-d6
Source Vendor ID: NMR/9291391; Lab Info: PRO; Lab Number: PRO-PP01431