| SpectraBase Spectrum ID |
JIRYfmhaLaa |
| Name |
Baclofen 3ME |
| Classification |
Pharmaceutical drug derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
255.102606522 u |
| Formula |
C13H18ClNO2 |
| InChI |
InChI=1S/C13H18ClNO2/c1-15(2)9-11(8-13(16)17-3)10-4-6-12(14)7-5-10/h4-7,11H,8-9H2,1-3H3 |
| InChIKey |
ITNSTAYIPLFNNU-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
255.745 g/mol |
| Nominal Mass |
255 u |
| Quality |
907 |
| Retention Index |
1853 |
| SMILES |
C(C=1C=CC(=CC1)Cl)(CC(OC)=O)CN(C)C |
| SPLASH |
splash10-0a4i-9200000000-b3e4d6334714227c98e2 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
methyl 3-(4-chlorophenyl)-4-(dimethylamino)butanoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_000198 |
