(1S,4S)-4-[1-(3-Bromophenyl)-3,5-dimethyl-1H-pyrazol-4-yl]-N-(4-methoxybenzyl)-2-cyclopenten-1-amine
12050
Reference
(1S,4S)-4-[1-(3-Bromophenyl)-3,5-dimethyl-1H-pyrazol-4-yl]-N-(4-methoxybenzyl)-2-cyclopenten-1-amine Structure
Systematic / IUPAC Name: (1S,4S)-4-[1-(3-Bromophenyl)-3,5-dimethylpyrazol-4-yl]-N-[(4-methoxyphenyl)methyl]cyclopent-2-en-1-amine
ID: Reference12050
Other Names: NAT16-353410
Formula: C24H26BrN3O
Spectral Data
(1S,4S)-4-[1-(3-Bromophenyl)-3,5-dimethyl-1H-pyrazol-4-yl]-N-(4-methoxybenzyl)-2-cyclopenten-1-amine 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 | 1 |
| No. of Spectra | 780 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 12/13/2022 11:00:36 AM |
Identificators
| InChI | InChI=1S/C24H26BrN3O/c1-16-24(17(2)28(27-16)22-6-4-5-20(25)14-22)19-9-10-21(13-19)26-15-18-7-11-23(29-3)12-8-18/h4-12,14,19,21,26H,13,15H2,1-3H3/t19-,21-/m1/s1 |
| InChI Key | AQBGSUBVFNNOQT-TZIWHRDSSA-N |
| Canonical SMILES | CC1=C(C(=NN1C2=CC(=CC=C2)Br)C)C3CC(C=C3)NCC4=CC=C(C=C4)OC |
| CAS | |
| Splash | |
| Other Names | NAT16-353410 |