| SpectraBase Spectrum ID |
JGc4I9Bt7Ee |
| Name |
JTE-907 |
| CAS Registry Number |
282089-49-0 |
| Classification |
Cannabimimetic CB2 (inverse agonist) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
438.179086559 u |
| Formula |
C24H26N2O6 |
| InChI |
InChI=1S/C24H26N2O6/c1-3-4-5-10-30-22-19(29-2)9-7-16-12-17(24(28)26-21(16)22)23(27)25-13-15-6-8-18-20(11-15)32-14-31-18/h6-9,11-12H,3-5,10,13-14H2,1-2H3,(H,25,27)(H,26,28) |
| InChIKey |
GRAJFFFXJYFVOC-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
438.480 g/mol |
| Nominal Mass |
438 u |
| Quality |
833 |
| Retention Index |
3398 |
| SMILES |
C12=C(C=C(C(N2)=O)C(NCC=2C=C3C(=CC2)OCO3)=O)C=CC(=C1OCCCCC)OC |
| SPLASH |
splash10-0udi-2941000000-8398a52fabbab4ed9c6c |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
N-(Benzo[1,3]dioxol-5-ylmethyl)-7-methoxy-2-oxo-8-pentyloxy-1,2-dihydroquinoline-3-\rcarboxamide |
| Technique |
GC/MS |
| Wiley ID |
DD2024_017230 |
