{(3R,4S)-3-{2-[4-(4-Fluorophenyl)-1-piperazinyl]ethyl}-1-[(4-methoxyphenyl)acetyl]-4-piperidinyl}acetic acid
11796
Reference
{(3R,4S)-3-{2-[4-(4-Fluorophenyl)-1-piperazinyl]ethyl}-1-[(4-methoxyphenyl)acetyl]-4-piperidinyl}acetic acid Structure
Systematic / IUPAC Name: 2-[(3R,4S)-3-[2-[4-(4-Fluorophenyl)piperazin-1-yl]ethyl]-1-[2-(4-methoxyphenyl)acetyl]piperidin-4-yl]acetic acid
ID: Reference11796
Other Names: NAT14-336632
Formula: C28H36FN3O4
Spectral Data
{(3R,4S)-3-{2-[4-(4-Fluorophenyl)-1-piperazinyl]ethyl}-1-[(4-methoxyphenyl)acetyl]-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 | 965 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 9/30/2022 7:47:22 AM |
Identificators
| InChI | InChI=1S/C28H36FN3O4/c1-36-26-8-2-21(3-9-26)18-27(33)32-13-11-22(19-28(34)35)23(20-32)10-12-30-14-16-31(17-15-30)25-6-4-24(29)5-7-25/h2-9,22-23H,10-20H2,1H3,(H,34,35)/t22-,23-/m0/s1 |
| InChI Key | DHSGURFCQINIPI-GOTSBHOMSA-N |
| Canonical SMILES | COC1=CC=C(C=C1)CC(=O)N2CCC(C(C2)CCN3CCN(CC3)C4=CC=C(C=C4)F)CC(=O)O |
| CAS | |
| Splash | |
| Other Names | NAT14-336632 |