CP-100829
3151
Reference
CP-100829 Structure
Systematic / IUPAC Name: (3Z)-6-Chloro-3-[(4-chloro-2-thienyl)(hydroxy)methylene]-5-fluoro-2-oxo-1-indolinecarboxamide
ID: Reference3151
Other Names: 1H-Indole-1-carboxamide, 6-chloro-3-((4-chloro-2-thienyl)carbonyl)-5-fluoro-2,3-dihydro-2-oxo-
Formula: C14H7Cl2FN2O3S
Spectral Data
CP-100829 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 | Q Exactive Orbitrap |
| No. of Spectral Trees | 2 |
| No. of Spectra | 210 |
| Tandem Spectra | MS1, MS2 |
| Ionization Methods | ESI |
| Analyzers | FT |
| Last Modification | 10/22/2015 7:56:50 AM |
Identificators
| InChI | InChI=1S/C14H7Cl2FN2O3S/c15-5-1-10(23-4-5)12(20)11-6-2-8(17)7(16)3-9(6)19(13(11)21)14(18)22/h1-4,20H,(H2,18,22)/b12-11- |
| InChI Key | RQPSIRZEVZUYOF-QXMHVHEDSA-N |
| Canonical SMILES | C1=C2C(=CC(=C1F)Cl)N(C(=O)C2=C(C3=CC(=CS3)Cl)O)C(=O)N |
| CAS | 172618052 |
| Splash | |
| Other Names | 1H-Indole-1-carboxamide, 6-chloro-3-((4-chloro-2-thienyl)carbonyl)-5-fluoro-2,3-dihydro-2-oxo- |