1-({(2R,3S,4R,5S)-3,4-Dihydroxy-5-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]tetrahydro-2-furanyl}methyl)-3-isopropylurea
9117
Reference
1-({(2R,3S,4R,5S)-3,4-Dihydroxy-5-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]tetrahydro-2-furanyl}methyl)-3-isopropylurea Structure
Systematic / IUPAC Name: 1-[[(2R,3S,4R,5S)-3,4-Dihydroxy-5-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]oxolan-2-yl]methyl]-3-propan-2-ylurea
ID: Reference9117
Other Names: NAT19-353787
Formula: C21H32N4O5
Spectral Data
1-({(2R,3S,4R,5S)-3,4-Dihydroxy-5-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]tetrahydro-2-furanyl}methyl)-3-isopropylurea 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 | 500 |
| Tandem Spectra | MS1, MS2, MS3, MS4, MS5 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 11/14/2019 7:33:03 AM |
Identificators
| InChI | InChI=1S/C21H32N4O5/c1-14(2)23-21(29)22-13-17-20(28)19(27)16(30-17)12-18(26)25-10-8-24(9-11-25)15-6-4-3-5-7-15/h3-7,14,16-17,19-20,27-28H,8-13H2,1-2H3,(H2,22,23,29)/t16-,17+,19-,20+/m0/s1 |
| InChI Key | RLAVMTBKQLXPDK-KVPLUYHFSA-N |
| Canonical SMILES | CC(C)NC(=O)NCC1C(C(C(O1)CC(=O)N2CCN(CC2)C3=CC=CC=C3)O)O |
| CAS | |
| Splash | |
| Other Names | NAT19-353787 |