2-{[2-Hydroxyimino-2-(4-nitrophenyl)ethyl]thio}benzoic acid

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

Spectral Data

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.

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Available MS Data

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
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Identificators

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}-

In Other Databases

ChemSpider 7857775
PubChem 9583628