SpectraBase Spectrum ID |
CusIy2cpnag |
Name |
3-quinazolineacetic acid, 3,4-dihydro-4-oxo-, 2-[(1,1-dioxido-1,2-benzisothiazol-3-yl)methylamino]ethyl 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 |
426.099790865 u |
Formula |
C20H18N4O5S |
InChI |
InChI=1S/C20H18N4O5S/c1-23(19-15-7-3-5-9-17(15)30(27,28)22-19)10-11-29-18(25)12-24-13-21-16-8-4-2-6-14(16)20(24)26/h2-9,13H,10-12H2,1H3 |
InChIKey |
DSFDHOQALWRIPK-UHFFFAOYSA-N |
Molecular Weight |
426.447 g/mol |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_4710 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/9273525; Lab Info: LP; Lab Number: LP-0190701 |
Temperature |
29.85 °C |