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1-methyl-1,2,5,6-tetrahydronicotinic acid, methyl ester, hydrobromide
SpectraBase Compound ID FIWjRTqJ7WA
InChI InChI=1S/C8H13NO2.BrH/c1-9-5-3-4-7(6-9)8(10)11-2;/h4H,3,5-6H2,1-2H3;1H
InChIKey AXOJRQLKMVSHHZ-UHFFFAOYSA-N
Mol Weight 236.11 g/mol
Molecular Formula C8H14BrNO2
Exact Mass 235.020792 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9XoqHScCMTw
Name 1-METHYL-1,2,5,6-TETRAHYDRONICOTINIC ACID, METHYL ESTER, HYDROBROMIDE
Source of Sample L. Simeral, G. E. Maciel Org. Magn. Resonance 6, 226(1974)
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H13NO2 HBr
InChI InChI=1S/C8H13NO2.BrH/c1-9-5-3-4-7(6-9)8(10)11-2;/h4H,3,5-6H2,1-2H3;1H
InChIKey AXOJRQLKMVSHHZ-UHFFFAOYSA-N
Melting Point 170C
Molecular Weight 236.12
Solvent Water; Reference=Dioxane Spectrometer= Bruker HX-90