(1R,2S,3R,4R)-4-(4-Methoxyphenyl)-3-{[(1-methyl-1H-benzimidazol-2-yl)methyl]amino}-1,2-cyclopentanediol
11137
Reference
(1R,2S,3R,4R)-4-(4-Methoxyphenyl)-3-{[(1-methyl-1H-benzimidazol-2-yl)methyl]amino}-1,2-cyclopentanediol Structure
Systematic / IUPAC Name: (1R,2S,3R,4R)-4-(4-Methoxyphenyl)-3-[(1-methylbenzimidazol-2-yl)methylamino]cyclopentane-1,2-diol
ID: Reference11137
Other Names: NAT38-539569
Formula: C21H25N3O3
Spectral Data
(1R,2S,3R,4R)-4-(4-Methoxyphenyl)-3-{[(1-methyl-1H-benzimidazol-2-yl)methyl]amino}-1,2-cyclopentanediol 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 | 2 |
| No. of Spectra | 907 |
| Tandem Spectra | MS1, MS2, MS3 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 1/17/2022 3:07:45 PM |
Identificators
| InChI | InChI=1S/C21H25N3O3/c1-24-17-6-4-3-5-16(17)23-19(24)12-22-20-15(11-18(25)21(20)26)13-7-9-14(27-2)10-8-13/h3-10,15,18,20-22,25-26H,11-12H2,1-2H3/t15-,18-,20-,21-/m1/s1 |
| InChI Key | YQDBFTYYFIUICK-ZQYQINFJSA-N |
| Canonical SMILES | CN1C2=CC=CC=C2N=C1CNC3C(CC(C3O)O)C4=CC=C(C=C4)OC |
| CAS | |
| Splash | |
| Other Names | NAT38-539569 |