Systematic / IUPAC Name: 2-{[(2Z)-2-(Hydroxyimino)-2-(4-nitrophenyl)ethyl]sulfanyl}benzoic acid
ID: Reference6942
Other Names: Benzoic acid, 2-{[(2Z)-2-(hydroxyimino)-2-(4-nitrophenyl)ethyl]thio}-
Formula: C15H12N2O5S
2-{[2-Hydroxyimino-2-(4-nitrophenyl)ethyl]thio}benzoic acid mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Q Exactive Orbitrap |
No. of Spectral Trees | 1 |
No. of Spectra | 119 |
Tandem Spectra | MS1, MS2 |
Ionization Methods | ESI |
Analyzers | FT |
Last Modification | 10/20/2017 6:52:33 AM |
InChI | InChI=1S/C15H12N2O5S/c18-15(19)12-3-1-2-4-14(12)23-9-13(16-20)10-5-7-11(8-6-10)17(21)22/h1-8,20H,9H2,(H,18,19)/b16-13+ |
InChI Key | AGTBVLFTNFMDTG-DTQAZKPQSA-N |
Canonical SMILES | |
CAS | |
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Other Names | Benzoic acid, 2-{[(2Z)-2-(hydroxyimino)-2-(4-nitrophenyl)ethyl]thio}- |