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3H-1,2,4-triazole-3-thione, 2,4-dihydro-4-phenyl-5-(phenylmethyl)-2-(1-pyrrolidinylmethyl)-

View entire compound with spectra: 1 NMR

3H-1,2,4-triazole-3-thione, 2,4-dihydro-4-phenyl-5-(phenylmethyl)-2-(1-pyrrolidinylmethyl)-
SpectraBase Compound ID DrgwVPSW4Hl
InChI InChI=1S/C20H22N4S/c25-20-23(16-22-13-7-8-14-22)21-19(15-17-9-3-1-4-10-17)24(20)18-11-5-2-6-12-18/h1-6,9-12H,7-8,13-16H2
InChIKey CKENEKWRWUDHGU-UHFFFAOYSA-N
Mol Weight 350.48 g/mol
Molecular Formula C20H22N4S
Exact Mass 350.156518 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CnsbNHwa5ZZ
Name 3H-1,2,4-triazole-3-thione, 2,4-dihydro-4-phenyl-5-(phenylmethyl)-2-(1-pyrrolidinylmethyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 350.156517898 u
Formula C20H22N4S
InChI InChI=1S/C20H22N4S/c25-20-23(16-22-13-7-8-14-22)21-19(15-17-9-3-1-4-10-17)24(20)18-11-5-2-6-12-18/h1-6,9-12H,7-8,13-16H2
InChIKey CKENEKWRWUDHGU-UHFFFAOYSA-N
Molecular Weight 350.484 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_6562
Solvent DMSO-d6
Source Vendor ID: NMR/9243593; Lab Info: LP; Lab Number: LP-2190654