Metabolite: MDC-Cat-HPLC-E-POS-F1-394.159-1.75
Predicted Metabolite: Loganic acid
Class: Terpenoid
| Experimental aligned m/z | 394.1592 |
| Ion Type | [M+NH4]+ |
| Nominal mass | 394.0 |
| Even nominal mass? | true |
| Metabolite annotation | Loganic acid |
| Elemental formula of neutral metabolite | C16H24O10 |
| Theoretical m/z | 394.17077 |
| MarkerLynx Significance Score | 0.0101 |
| Comments | Neutral loss of 162, adducts of M+NH4, M+Na, and M+K, and fragments of 179, 151, and 109 which are also found in loganin |
| D m/z (ppm) | 29.35275997255219 |
| Metabolite synonyms | MDC-Cat-HPLC-E-POS-F1-377.13-1.75; MDC-Cat-HPLC-E-POS-F1-415.086-1.73; MDC-Cat-HPLC-E-POS-F1-399.112-1.76 |
| PubChem database reference | 89640.0 |
| Relative mass defect (ppm) | 403.89771442604524 |
| Retention Time (min) | 1.7537 |