| SpectraBase Spectrum ID |
AcirmWmgY5z |
| Name |
4-((4-chlorophenyl)ethynyl)-3-(4-isopropoxyphenyl)-7-methyl-2H-chromen-2-one |
| Appearance |
Yellow solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H21ClO3 |
| InChI |
InChI=1S/C27H21ClO3/c1-17(2)30-22-12-8-20(9-13-22)26-24(15-7-19-5-10-21(28)11-6-19)23-14-4-18(3)16-25(23)31-27(26)29/h4-6,8-14,16-17H,1-3H3 |
| InChIKey |
SDIIOJGSILHHAW-UHFFFAOYSA-N |
| Instrument Name |
Waters CAB155 GCT Premier |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ajoc.202100279 |
| Molecular Weight |
428.915 g/mol |
| SMILES |
C(Oc1ccc(cc1)C=1C(Oc2c(C1C#Cc1ccc(cc1)Cl)ccc(c2)C)=O)(C)C |
| SPLASH |
splash10-052r-1169200000-e04b4e866df5076ed3fc |
| Source of Spectrum |
AJO-10-SM93-4.12 |
| Wiley ID |
1866394 |
