Systematic / IUPAC Name: (2S,3S,4R,5R)-5-[[(3-Chlorophenyl)methylamino]methyl]-2-(hydroxymethyl)-4-[(2R)-2-(methoxymethyl)pyrrolidin-1-yl]oxolan-3-ol
ID: Reference12755
Other Names:
D-Galactitol, 2,5-anhydro-6-[[(3-chlorophenyl)methyl]amino]-4,6-dideoxy-4-[(2R)-2-(methoxymethyl)-1-pyrrolidinyl]-;
NAT27-401406
Formula: C19H29ClN2O4
2,5-Anhydro-6-[(3-chlorobenzyl)amino]-4,6-dideoxy-4-[(2R)-2-(methoxymethyl)-1-pyrrolidinyl]-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 | 1 |
No. of Spectra | 1073 |
Tandem Spectra | MS1, MS2, MS3, MS4 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 9/12/2023 8:49:41 AM |
InChI | InChI=1S/C19H29ClN2O4/c1-25-12-15-6-3-7-22(15)18-16(26-17(11-23)19(18)24)10-21-9-13-4-2-5-14(20)8-13/h2,4-5,8,15-19,21,23-24H,3,6-7,9-12H2,1H3/t15-,16-,17+,18+,19-/m1/s1 |
InChI Key | RNTDEDZGQGKXSH-ZSXDVEMLSA-N |
Canonical SMILES | COCC1CCCN1C2C(OC(C2O)CO)CNCC3=CC(=CC=C3)Cl |
CAS | |
Splash | |
Other Names |
D-Galactitol, 2,5-anhydro-6-[[(3-chlorophenyl)methyl]amino]-4,6-dideoxy-4-[(2R)-2-(methoxymethyl)-1-pyrrolidinyl]-; NAT27-401406 |