| SpectraBase Spectrum ID |
CyG7LqnAnsM |
| Name |
Tramadol-A (-H2O) |
| Classification |
Pharmaceutical drug, analgesic |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
245.177964364 u |
| Formula |
C16H23NO |
| InChI |
InChI=1S/C16H23NO/c1-17(2)12-14-7-4-5-10-16(14)13-8-6-9-15(11-13)18-3/h6,8-11,14H,4-5,7,12H2,1-3H3/t14-/m1/s1 |
| InChIKey |
NLNQAKPOVVMNEG-CQSZACIVSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
245.366 g/mol |
| Nominal Mass |
245 u |
| Quality |
996 |
| Retention Index |
1921 |
| SMILES |
C=1([C@@](CN(C)C)(CCCC1)[H])C1=CC(=CC=C1)OC |
| SPLASH |
splash10-0a4i-9100000000-024c72bdb290f24f1671 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
((2S)-3'-methoxy[2,3,4,5-tetrahydro-1,1'-biphenyl]-2-yl)-N,N-dimethylmethanamine |
| Technique |
GC/MS |
| Wiley ID |
DD2024_033160 |
