Systematic / IUPAC Name: (2S,3S,4R,5R)-5-[[(3-Chlorophenyl)methylamino]methyl]-2-(hydroxymethyl)-4-(4-phenylpiperazin-1-yl)oxolan-3-ol
ID: Reference10561
Other Names:
D-Galactitol, 2,5-anhydro-6-[[(3-chlorophenyl)methyl]amino]-4,6-dideoxy-4-(4-phenyl-1-piperazinyl)-;
NAT27-401190
Formula: C23H30ClN3O3
2,5-Anhydro-6-[(3-chlorobenzyl)amino]-4,6-dideoxy-4-(4-phenyl-1-piperazinyl)-D-galactitol mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
No. of Spectral Trees | 2 |
No. of Spectra | 2743 |
Tandem Spectra | MS1, MS2, MS3, MS4 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 6/18/2021 8:20:10 AM |
InChI | InChI=1S/C23H30ClN3O3/c24-18-6-4-5-17(13-18)14-25-15-20-22(23(29)21(16-28)30-20)27-11-9-26(10-12-27)19-7-2-1-3-8-19/h1-8,13,20-23,25,28-29H,9-12,14-16H2/t20-,21+,22+,23-/m1/s1 |
InChI Key | QPGLYZWIFVQKIW-WZYRSQIMSA-N |
Canonical SMILES | C1CN(CCN1C2C(OC(C2O)CO)CNCC3=CC(=CC=C3)Cl)C4=CC=CC=C4 |
CAS | |
Splash | |
Other Names |
D-Galactitol, 2,5-anhydro-6-[[(3-chlorophenyl)methyl]amino]-4,6-dideoxy-4-(4-phenyl-1-piperazinyl)-; NAT27-401190 |