3-(2,3-Dihydro-1H-indol-1-yl)-2-{[5-(trifluoromethyl)-2-pyridyl]sulfonyl}acrylonitrile
3520
Reference
3-(2,3-Dihydro-1H-indol-1-yl)-2-{[5-(trifluoromethyl)-2-pyridyl]sulfonyl}acrylonitrile Structure
Systematic / IUPAC Name: (2E)-3-(2,3-Dihydro-1H-indol-1-yl)-2-{[5-(trifluoromethyl)-2-pyridinyl]sulfonyl}acrylonitrile
ID: Reference3520
Other Names:
Formula: C17H12F3N3O2S
Spectral Data
3-(2,3-Dihydro-1H-indol-1-yl)-2-{[5-(trifluoromethyl)-2-pyridyl]sulfonyl}acrylonitrile 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 Elite; Q Exactive Orbitrap |
| No. of Spectral Trees | 2 |
| No. of Spectra | 1755 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | ESI; NSI |
| Analyzers | IT; FT |
| Last Modification | 1/11/2016 7:52:23 AM |
Identificators
| InChI | InChI=1S/C17H12F3N3O2S/c18-17(19,20)13-5-6-16(22-10-13)26(24,25)14(9-21)11-23-8-7-12-3-1-2-4-15(12)23/h1-6,10-11H,7-8H2/b14-11+ |
| InChI Key | KCQYCOYDAIPGOZ-SDNWHVSQSA-N |
| Canonical SMILES | C1CN(C2=CC=CC=C21)C=C(C#N)S(=O)(=O)C3=NC=C(C=C3)C(F)(F)F |
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