[(3R,4S)-1-(Cyclopentylcarbonyl)-3-{2-[4-(4-fluorophenyl)-1-piperazinyl]ethyl}-4-piperidinyl]acetic acid
13119
Reference
[(3R,4S)-1-(Cyclopentylcarbonyl)-3-{2-[4-(4-fluorophenyl)-1-piperazinyl]ethyl}-4-piperidinyl]acetic acid Structure
Systematic / IUPAC Name: 2-[(3R,4S)-1-(Cyclopentanecarbonyl)-3-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]piperidin-4-yl]acetic acid
ID: Reference13119
Other Names: NAT14-336635
Formula: C25H36FN3O3
Spectral Data
[(3R,4S)-1-(Cyclopentylcarbonyl)-3-{2-[4-(4-fluorophenyl)-1-piperazinyl]ethyl}-4-piperidinyl]acetic acid mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
| No. of Spectral Trees | 1 |
| No. of Spectra | 680 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 4/26/2024 9:57:27 AM |
Identificators
| InChI | InChI=1S/C25H36FN3O3/c26-22-5-7-23(8-6-22)28-15-13-27(14-16-28)11-9-21-18-29(12-10-20(21)17-24(30)31)25(32)19-3-1-2-4-19/h5-8,19-21H,1-4,9-18H2,(H,30,31)/t20-,21-/m0/s1 |
| InChI Key | GJLXQBWDYUOMQM-SFTDATJTSA-N |
| Canonical SMILES | C1CCC(C1)C(=O)N2CCC(C(C2)CCN3CCN(CC3)C4=CC=C(C=C4)F)CC(=O)O |
| CAS | |
| Splash | |
| Other Names | NAT14-336635 |