6,7-Dimethoxy-1-methyl-3-isoquinolyl 2-methyl-5-nitrobenzene-1-sulfonate

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Systematic / IUPAC Name: 6,7-Dimethoxy-1-methyl-3-isoquinolinyl 2-methyl-5-nitrobenzenesulfonate

ID: Reference7148

Other Names: Benzenesulfonic acid, 2-methyl-5-nitro-, 6,7-dimethoxy-1-methyl-3-isoquinolinyl ester

Formula: C19H18N2O7S

Spectral Data

6,7-Dimethoxy-1-methyl-3-isoquinolyl 2-methyl-5-nitrobenzene-1-sulfonate 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 12/7/2017 1:49:50 PM
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Identificators

InChI InChI=1S/C19H18N2O7S/c1-11-5-6-14(21(22)23)9-18(11)29(24,25)28-19-8-13-7-16(26-3)17(27-4)10-15(13)12(2)20-19/h5-10H,1-4H3
InChI Key BFQCXYPBWBBRJF-UHFFFAOYSA-N
Canonical SMILES
CAS
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Other Names Benzenesulfonic acid, 2-methyl-5-nitro-, 6,7-dimethoxy-1-methyl-3-isoquinolinyl ester

In Other Databases

PubChem 2727881
ChemSpider 2009889