| SpectraBase Spectrum ID |
JILbF05SUFs |
| Name |
Ketamine-M (-NHCH3,OH) |
| Classification |
Pharmaceutical drug metabolite |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
222.044757292 u |
| Formula |
C12H11ClO2 |
| InChI |
InChI=1S/C12H11ClO2/c13-11-4-2-1-3-9(11)10-6-5-8(14)7-12(10)15/h1-4,6,8,14H,5,7H2 |
| InChIKey |
IBSUWXJADZIFNS-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
222.671 g/mol |
| Nominal Mass |
222 u |
| Quality |
845 |
| Retention Index |
1599 |
| SMILES |
OC1CC(C(C=2C(=CC=CC2)Cl)=CC1)=O |
| SPLASH |
splash10-000i-2910000000-8c38a85f5ce69d4d6f07 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
2'-Chloro-4-hydroxy-4,5-dihydro[1,1'-biphenyl]-2(3H)-one |
| Technique |
GC/MS |
| Wiley ID |
DD2024_012968 |
