| SpectraBase Spectrum ID |
AYe0394cRCr |
| Name |
7-Chloro-3-hydroxymethyl-3-(4H-1,2,4-triazol-4-yl)-4H-1-benzopyran-4-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H10ClN3O3 |
| InChI |
InChI=1S/C12H10ClN3O3/c13-8-1-2-9-10(3-8)19-5-12(4-17,11(9)18)16-6-14-15-7-16/h1-3,6-7,17H,4-5H2 |
| InChIKey |
PXNAWVQGLGRHSN-UHFFFAOYSA-N |
| Molecular Weight |
279.683 g/mol |
| SMILES |
OCC1(C(c2ccc(cc2OC1)Cl)=O)[n]1cnnc1 |
| SPLASH |
splash10-0udi-0950000000-ac79f7371aed1f624387 |
| Source of Spectrum |
O1-55-2068-15 |
| Synonyms |
7-Chloro-3-(hydroxymethyl)-3-(4H-1,2,4-triazol-4-yl)-2,3-dihydro-4H-chromen-4-one |
| Wiley ID |
1591345 |
