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o-{[2,5-dimethoxy-alpha-(1-nitroethyl)benzyl]thio}aniline
SpectraBase Compound ID BCsGdbQsAY0
InChI InChI=1S/C17H20N2O4S/c1-11(19(20)21)17(24-16-7-5-4-6-14(16)18)13-10-12(22-2)8-9-15(13)23-3/h4-11,17H,18H2,1-3H3
InChIKey VPNFKKKZRFPSEF-UHFFFAOYSA-N
Mol Weight 348.42 g/mol
Molecular Formula C17H20N2O4S
Exact Mass 348.114378 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KodaPcXY1e4
Name o-{[2,5-DIMETHOXY-alpha-(1-NITROETHYL)BENZYL]THIO}ANILINE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20N2O4S
InChI InChI=1S/C17H20N2O4S/c1-11(19(20)21)17(24-16-7-5-4-6-14(16)18)13-10-12(22-2)8-9-15(13)23-3/h4-11,17H,18H2,1-3H3
InChIKey VPNFKKKZRFPSEF-UHFFFAOYSA-N
Melting Point 85C
Molecular Weight 348.42
Solvent Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300
Synonyms ANILINE, o-{[2,5-DIMETHOXY-alpha-(1-NITROETHYL)BENZYL]THIO}-,