Systematic / IUPAC Name: 4-(Dimethylamino)-N-[(1S,4S)-4-[3,5-dimethyl-1-[4-(trifluoromethyl)phenyl]pyrazol-4-yl]cyclopent-2-en-1-yl]benzamide
ID: Reference10115
Other Names:
Benzamide, 4-(dimethylamino)-N-[(1S,4S)-4-[3,5-dimethyl-1-[4-(trifluoromethyl)phenyl]-1H-pyrazol-4-yl]-2-cyclopenten-1-yl]-;
NAT16-368443
Formula: C26H27F3N4O
4-(Dimethylamino)-N-[(1S,4S)-4-{3,5-dimethyl-1-[4-(trifluoromethyl)phenyl]-1H-pyrazol-4-yl}-2-cyclopenten-1-yl]benzamide 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 | 1238 |
Tandem Spectra | MS1, MS2, MS3, MS4, MS5 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 9/22/2023 9:58:26 AM |
InChI | InChI=1S/C26H27F3N4O/c1-16-24(17(2)33(31-16)23-13-8-20(9-14-23)26(27,28)29)19-5-10-21(15-19)30-25(34)18-6-11-22(12-7-18)32(3)4/h5-14,19,21H,15H2,1-4H3,(H,30,34)/t19-,21-/m1/s1 |
InChI Key | FHWHWAYPHOEQEX-TZIWHRDSSA-N |
Canonical SMILES | CC1=C(C(=NN1C2=CC=C(C=C2)C(F)(F)F)C)C3CC(C=C3)NC(=O)C4=CC=C(C=C4)N(C)C |
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Other Names |
Benzamide, 4-(dimethylamino)-N-[(1S,4S)-4-[3,5-dimethyl-1-[4-(trifluoromethyl)phenyl]-1H-pyrazol-4-yl]-2-cyclopenten-1-yl]-; NAT16-368443 |