[(3R,4S)-1-(Cyclohexylcarbonyl)-3-(2-{[2-(4-morpholinyl)ethyl](phenyl)amino}ethyl)-4-piperidinyl]acetic acid
12070
Reference
[(3R,4S)-1-(Cyclohexylcarbonyl)-3-(2-{[2-(4-morpholinyl)ethyl](phenyl)amino}ethyl)-4-piperidinyl]acetic acid Structure
Systematic / IUPAC Name: 2-[(3R,4S)-1-(Cyclohexanecarbonyl)-3-[2-[N-(2-morpholin-4-ylethyl)anilino]ethyl]piperidin-4-yl]acetic acid
ID: Reference12070
Other Names: NAT14-337028
Formula: C28H43N3O4
Spectral Data
[(3R,4S)-1-(Cyclohexylcarbonyl)-3-(2-{[2-(4-morpholinyl)ethyl](phenyl)amino}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 | 1229 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 12/20/2022 9:00:08 AM |
Identificators
| InChI | InChI=1S/C28H43N3O4/c32-27(33)21-24-11-14-31(28(34)23-7-3-1-4-8-23)22-25(24)12-13-30(26-9-5-2-6-10-26)16-15-29-17-19-35-20-18-29/h2,5-6,9-10,23-25H,1,3-4,7-8,11-22H2,(H,32,33)/t24-,25-/m0/s1 |
| InChI Key | DTFILVHLQHUHSG-DQEYMECFSA-N |
| Canonical SMILES | C1CCC(CC1)C(=O)N2CCC(C(C2)CCN(CCN3CCOCC3)C4=CC=CC=C4)CC(=O)O |
| CAS | |
| Splash | |
| Other Names | NAT14-337028 |