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1H-benzimidazole-1-propanenitrile, 2-[2-[(4-methylphenyl)sulfonyl]ethyl]-
SpectraBase Compound ID 3IaDTTnK2uv
InChI InChI=1S/C19H19N3O2S/c1-15-7-9-16(10-8-15)25(23,24)14-11-19-21-17-5-2-3-6-18(17)22(19)13-4-12-20/h2-3,5-10H,4,11,13-14H2,1H3
InChIKey LBWBFOYVXRZDJB-UHFFFAOYSA-N
Mol Weight 353.44 g/mol
Molecular Formula C19H19N3O2S
Exact Mass 353.119798 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IXwfWDjT2Ir
Name 1H-benzimidazole-1-propanenitrile, 2-[2-[(4-methylphenyl)sulfonyl]ethyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 353.119798036 u
Formula C19H19N3O2S
InChI InChI=1S/C19H19N3O2S/c1-15-7-9-16(10-8-15)25(23,24)14-11-19-21-17-5-2-3-6-18(17)22(19)13-4-12-20/h2-3,5-10H,4,11,13-14H2,1H3
InChIKey LBWBFOYVXRZDJB-UHFFFAOYSA-N
Molecular Weight 353.440 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_457
Solvent DMSO-d6
Source Vendor ID: NMR/8275113; Lab Info: AI; Lab Number: AI-ais124
Temperature 29.85 °C