SpectraBase Spectrum ID |
HreOgX8s83L |
Name |
2-(Cyanomethyl)-5-hydroxy-7-(4-methoxyphenyl)-4,7-dihydrothiazolo[4,5-b]pyridine-6-carbonitrile |
Appearance |
Yellow crystals |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C16H12N4O2S |
InChI |
InChI=1S/C16H12N4O2S/c1-22-10-4-2-9(3-5-10)13-11(8-18)16(21)20-15-14(13)23-12(19-15)6-7-17/h2-5,13,20-21H,6H2,1H3 |
InChIKey |
REUIKJNEHXHVPM-UHFFFAOYSA-N |
Instrument Name |
Hewlett Packard 5988 A or Shimadzu QP 1000 Ex |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/jhet.3870 |
Molecular Weight |
324.358 g/mol |
SMILES |
N1c2c(C(C(=C1O)C#N)c1ccc(cc1)OC)sc(n2)CC#N |
SPLASH |
splash10-0a4i-9000000000-076c89e8fdf715685737 |
Source of Spectrum |
Y-57-1340-6f |
Wiley ID |
1860094 |