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acetamide, 2-(2,4-dimethylphenoxy)-N-[2-methyl-5-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]-
SpectraBase Compound ID Fq94DchIDI3
InChI InChI=1S/C21H21N5O2S/c1-12-5-8-18(14(3)9-12)28-11-19(27)22-17-10-16(7-6-13(17)2)20-25-26-15(4)23-24-21(26)29-20/h5-10H,11H2,1-4H3,(H,22,27)
InChIKey LEGRRFZEUMXFRT-UHFFFAOYSA-N
Mol Weight 407.49 g/mol
Molecular Formula C21H21N5O2S
Exact Mass 407.141596 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AH3qT03wqdh
Name acetamide, 2-(2,4-dimethylphenoxy)-N-[2-methyl-5-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 407.141596108 u
Formula C21H21N5O2S
InChI InChI=1S/C21H21N5O2S/c1-12-5-8-18(14(3)9-12)28-11-19(27)22-17-10-16(7-6-13(17)2)20-25-26-15(4)23-24-21(26)29-20/h5-10H,11H2,1-4H3,(H,22,27)
InChIKey LEGRRFZEUMXFRT-UHFFFAOYSA-N
Molecular Weight 407.492 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_8487
Solvent DMSO-d6
Source Vendor ID: NMR/13309431