| SpectraBase Spectrum ID |
JHULXEtG6zo |
| Name |
Carbocromene |
| CAS Registry Number |
804-10-4 |
| Classification |
Pharmaceutical drug, coronary vasodilator |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
361.188922968 u |
| Formula |
C20H27NO5 |
| InChI |
InChI=1S/C20H27NO5/c1-5-21(6-2)11-10-17-14(4)16-9-8-15(12-18(16)26-20(17)23)25-13-19(22)24-7-3/h8-9,12H,5-7,10-11,13H2,1-4H3 |
| InChIKey |
KLOIYEQEVSIOOO-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
361.438 g/mol |
| Nominal Mass |
361 u |
| Quality |
997 |
| Retention Index |
2695 |
| SMILES |
C=12C(C(=C(C(O2)=O)CCN(CC)CC)C)=CC=C(C1)OCC(OCC)=O |
| SPLASH |
splash10-000i-9000000000-7295fa4552cb4fb297eb |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Ethyl 2-[3-(2-diethylaminoethyl)-4-methyl-2-oxo-chromen-7-yl]oxy acetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_000466 |
