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2-[[4-(4-morpholinyl)-6-(N-phenylanilino)-1,3,5-triazin-2-yl]thio]acetic acid
SpectraBase Compound ID HqfNdekvfv0
InChI InChI=1S/C21H21N5O3S/c27-18(28)15-30-21-23-19(25-11-13-29-14-12-25)22-20(24-21)26(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-10H,11-15H2,(H,27,28)
InChIKey UXOFMEORKVRBED-UHFFFAOYSA-N
Mol Weight 423.49 g/mol
Molecular Formula C21H21N5O3S
Exact Mass 423.136511 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DB30CcMfIgx
Name acetic acid, [[4-(diphenylamino)-6-(4-morpholinyl)-1,3,5-triazin-2-yl]thio]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 423.136510727 u
Formula C21H21N5O3S
InChI InChI=1S/C21H21N5O3S/c27-18(28)15-30-21-23-19(25-11-13-29-14-12-25)22-20(24-21)26(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-10H,11-15H2,(H,27,28)
InChIKey UXOFMEORKVRBED-UHFFFAOYSA-N
Molecular Weight 423.491 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_14059
Solvent DMSO-d6
Source Vendor ID: NMR/10311951; Lab Info: KE; Lab Number: KE-0120004