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acetic acid, [[4-chloro-6-[(3-methylphenyl)amino]-1,3,5-triazin-2-yl]amino]-, methyl ester
SpectraBase Compound ID 9XJ3cOS7opR
InChI InChI=1S/C13H14ClN5O2/c1-8-4-3-5-9(6-8)16-13-18-11(14)17-12(19-13)15-7-10(20)21-2/h3-6H,7H2,1-2H3,(H2,15,16,17,18,19)
InChIKey KGLBHGGZYJOAEZ-UHFFFAOYSA-N
Mol Weight 307.74 g/mol
Molecular Formula C13H14ClN5O2
Exact Mass 307.083602 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KR3RVJVlN72
Name acetic acid, [[4-chloro-6-[(3-methylphenyl)amino]-1,3,5-triazin-2-yl]amino]-, methyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 307.083602409 u
Formula C13H14ClN5O2
InChI InChI=1S/C13H14ClN5O2/c1-8-4-3-5-9(6-8)16-13-18-11(14)17-12(19-13)15-7-10(20)21-2/h3-6H,7H2,1-2H3,(H2,15,16,17,18,19)
InChIKey KGLBHGGZYJOAEZ-UHFFFAOYSA-N
Molecular Weight 307.741 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_8627
Solvent DMSO-d6
Source Vendor ID: NMR/10210337; Lab Info: VOR; Lab Number: VOR-0000007
Temperature 23.85 °C