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[4-amino-6-(3-chloro-2-methylanilino)-1,3,5-triazin-2-yl]methyl 4-methyl-1-piperazinecarbodithioate
SpectraBase Compound ID 20HDnG1qkGA
InChI InChI=1S/C17H22ClN7S2/c1-11-12(18)4-3-5-13(11)20-16-22-14(21-15(19)23-16)10-27-17(26)25-8-6-24(2)7-9-25/h3-5H,6-10H2,1-2H3,(H3,19,20,21,22,23)
InChIKey YXYDWZLGRXHNGJ-UHFFFAOYSA-N
Mol Weight 423.99 g/mol
Molecular Formula C17H22ClN7S2
Exact Mass 423.106664 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BWR30OMxIEf
Name [4-amino-6-(3-chloro-2-methylanilino)-1,3,5-triazin-2-yl]methyl 4-methyl-1-piperazinecarbodithioate
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 423.106663784 u
Formula C17H22ClN7S2
InChI InChI=1S/C17H22ClN7S2/c1-11-12(18)4-3-5-13(11)20-16-22-14(21-15(19)23-16)10-27-17(26)25-8-6-24(2)7-9-25/h3-5H,6-10H2,1-2H3,(H3,19,20,21,22,23)
InChIKey YXYDWZLGRXHNGJ-UHFFFAOYSA-N
Molecular Weight 423.985 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_356
Solvent DMSO-d6
Source Vendor ID: NMR/12268095