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quinoline, 1,2-dihydro-2,2,4-trimethyl-1-[(4H-1,2,4-triazol-3-ylthio)acetyl]-
SpectraBase Compound ID J4mkFlpceIA
InChI InChI=1S/C16H18N4OS/c1-11-8-16(2,3)20(13-7-5-4-6-12(11)13)14(21)9-22-15-17-10-18-19-15/h4-8,10H,9H2,1-3H3,(H,17,18,19)
InChIKey HZXSFAUJYDGYNX-UHFFFAOYSA-N
Mol Weight 314.41 g/mol
Molecular Formula C16H18N4OS
Exact Mass 314.120132 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5kdgol6uPh8
Name quinoline, 1,2-dihydro-2,2,4-trimethyl-1-[(4H-1,2,4-triazol-3-ylthio)acetyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 314.120132389 u
Formula C16H18N4OS
InChI InChI=1S/C16H18N4OS/c1-11-8-16(2,3)20(13-7-5-4-6-12(11)13)14(21)9-22-15-17-10-18-19-15/h4-8,10H,9H2,1-3H3,(H,17,18,19)
InChIKey HZXSFAUJYDGYNX-UHFFFAOYSA-N
Molecular Weight 314.407 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_461
Solvent DMSO-d6
Source Vendor ID: ZI/6072337; Lab Info: BIS; Lab Number: SMN-0126655
Temperature 29.85 °C