| SpectraBase Spectrum ID |
3okcO5YttI |
| Name |
Baclofen PFP HFIP |
| Classification |
Pharmaceutical drug derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
509.025180708 u |
| Formula |
C16H11ClF11NO3 |
| InChI |
InChI=1S/C16H11ClF11NO3/c17-9-3-1-7(2-4-9)8(6-29-12(31)13(18,19)16(26,27)28)5-10(30)32-11(14(20,21)22)15(23,24)25/h1-4,8,11H,5-6H2,(H,29,31) |
| InChIKey |
LPDCCDJMTAYKKT-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
509.703 g/mol |
| Nominal Mass |
509 u |
| Quality |
890 |
| Retention Index |
3582 |
| SMILES |
C(C(F)(F)F)(C(NCC(C1=CC=C(C=C1)Cl)CC(OC(C(F)(F)F)C(F)(F)F)=O)=O)(F)F |
| SPLASH |
splash10-0006-2932000000-14d0e3a4b19569dbde66 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1,1,1,3,3,3-hexafluoropropan-2-yl 3-(4-chlorophenyl)-4-((2,2,3,3,3-pentafluoropropanoyl)amino)\rbutanoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_000201 |
