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HARMALINE-CATION

View entire compound with spectra: 1 NMR

HARMALINE-CATION
SpectraBase Compound ID 9Rtqfh0rStL
InChI InChI=1S/C13H14N2O.H2O4S/c1-8-13-11(5-6-14-8)10-4-3-9(16-2)7-12(10)15-13;1-5(2,3)4/h3-4,7,15H,5-6H2,1-2H3;(H2,1,2,3,4)
InChIKey JIVKRHKHZPNCMG-UHFFFAOYSA-N
Mol Weight 312.34 g/mol
Molecular Formula C13H16N2O5S
Exact Mass 312.077993 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K4jX9q85pA
Name HARMALINE-CATION
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H16N2O5S
InChI InChI=1S/C13H14N2O.H2O4S/c1-8-13-11(5-6-14-8)10-4-3-9(16-2)7-12(10)15-13;1-5(2,3)4/h3-4,7,15H,5-6H2,1-2H3;(H2,1,2,3,4)
InChIKey JIVKRHKHZPNCMG-UHFFFAOYSA-N
Literature Reference Author M.C.C.GUZMAN,M.B.ALMEIDA,J.H.TOLEDO,M.A.MUNOZ-PEREZ,M.L.POVE DA
Literature Reference Citation CAN.J.CHEM.,67,720(1989)
Literature Reference DOI 10.1139/v89-110
Molecular Weight 312.340 g/mol
Solvent APPROX.-0.1M-H2SO4
Source File Reference UWCS7022