| SpectraBase Spectrum ID |
LnR0Ose7XEN |
| Name |
COUMACHLOR |
| CAS Registry Number |
81-82-3 |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
342.065886659 u |
| Formula |
C19H15ClO4 |
| InChI |
InChI=1S/C19H15ClO4/c1-11(21)10-15(12-6-8-13(20)9-7-12)17-18(22)14-4-2-3-5-16(14)24-19(17)23/h2-9,15,23H,10H2,1H3 |
| InChIKey |
HENZOLWOIZODCT-UHFFFAOYSA-N |
| Molecular Weight |
342.778 g/mol |
| Nominal Mass |
342 u |
| Number of Peaks |
116 |
| SMILES |
OC1=C(C(c2ccccc2O1)=O)C(c1ccc(cc1)Cl)CC(C)=O |
| SPLASH |
splash10-006y-6943000000-15465a2e8ae9a6f0e9f4 |
| Source of Spectrum |
Dr. Rolf Kuehnle |
| Synonyms |
3-[1-(4-chlorophenyl)-3-oxobutyl]-2-hydroxy-4H-chromen-4-one |
| Technique |
GC/MS |
| Wiley ID |
WID_MSPA_3745 |
