N-({(2R,3S,4R,5S)-3,4-Dihydroxy-5-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]tetrahydro-2-furanyl}methyl)-4-methylbenzamide
9119
Reference
N-({(2R,3S,4R,5S)-3,4-Dihydroxy-5-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]tetrahydro-2-furanyl}methyl)-4-methylbenzamide Structure
Systematic / IUPAC Name: N-[[(2R,3S,4R,5S)-3,4-Dihydroxy-5-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]oxolan-2-yl]methyl]-4-methylbenzamide
ID: Reference9119
Other Names: NAT19-353796
Formula: C25H31N3O5
Spectral Data
N-({(2R,3S,4R,5S)-3,4-Dihydroxy-5-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]tetrahydro-2-furanyl}methyl)-4-methylbenzamide 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 FAIMS |
| No. of Spectral Trees | 1 |
| No. of Spectra | 1076 |
| Tandem Spectra | MS1, MS2, MS3, MS4, MS5 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 11/14/2019 7:35:11 AM |
Identificators
| InChI | InChI=1S/C25H31N3O5/c1-17-7-9-18(10-8-17)25(32)26-16-21-24(31)23(30)20(33-21)15-22(29)28-13-11-27(12-14-28)19-5-3-2-4-6-19/h2-10,20-21,23-24,30-31H,11-16H2,1H3,(H,26,32)/t20-,21+,23-,24+/m0/s1 |
| InChI Key | XUCRRVVYJNWQMW-SGKWCMOWSA-N |
| Canonical SMILES | CC1=CC=C(C=C1)C(=O)NCC2C(C(C(O2)CC(=O)N3CCN(CC3)C4=CC=CC=C4)O)O |
| CAS | |
| Splash | |
| Other Names | NAT19-353796 |