SpectraBase Spectrum ID |
2DjLPMygnda |
Name |
4-pyrimidinaminium, 5-(ethoxycarbonyl)-2-[(4-methyl-2-quinazolinyl)amino]-6-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 |
401.172598938 u |
Formula |
C22H21N6O2 |
InChI |
InChI=1S/C22H20N6O2/c1-3-30-20(29)17-18(14-9-5-4-6-10-14)26-22(27-19(17)23)28-21-24-13(2)15-11-7-8-12-16(15)25-21/h4-12H,3H2,1-2H3,(H3,23,24,25,26,27,28)/p+1 |
InChIKey |
KLTLIBDILKGKCD-UHFFFAOYSA-O |
Molecular Weight |
401.450 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_7126 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13300977; Lab Info: VGY; Lab Number: VGY 0018173 |