| SpectraBase Spectrum ID |
D71iBStOh0L |
| Name |
3-bromo-4-((4-isobutoxyphenyl)ethynyl)-7-methoxy-2H-chromen-2-one |
| Appearance |
Yellow solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H19BrO4 |
| InChI |
InChI=1S/C22H19BrO4/c1-14(2)13-26-16-7-4-15(5-8-16)6-10-19-18-11-9-17(25-3)12-20(18)27-22(24)21(19)23/h4-5,7-9,11-12,14H,13H2,1-3H3 |
| InChIKey |
ZCGGNQDGQAYAIG-UHFFFAOYSA-N |
| Instrument Name |
Waters CAB155 GCT Premier |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ajoc.202100279 |
| Molecular Weight |
427.294 g/mol |
| SMILES |
c1(OC)ccc2c(c1)OC(C(=C2C#Cc1ccc(cc1)OCC(C)C)Br)=O |
| SPLASH |
splash10-014i-9523100000-5b1ba68de23ebd2ed937 |
| Source of Spectrum |
AJO-10-SM81-3.3 |
| Wiley ID |
1866387 |
