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8,9-didehydro-6,8-dimethylergoline

View entire compound with spectra: 5 NMR, 1 FTIR, and 1 MS (GC)

8,9-didehydro-6,8-dimethylergoline
SpectraBase Compound ID JvPdYDV67vA
InChI InChI=1S/C16H18N2/c1-10-6-13-12-4-3-5-14-16(12)11(8-17-14)7-15(13)18(2)9-10/h3-6,8,13,15,17H,7,9H2,1-2H3/t13-,15-/m1/s1
InChIKey XJOOMMHNYOJWCZ-UKRRQHHQSA-N
Mol Weight 238.33 g/mol
Molecular Formula C16H18N2
Exact Mass 238.146999 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 95jbOmaUtPQ
Name AGROCLAVINE
Compound Number 6A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H18N2
InChI InChI=1S/C16H18N2/c1-10-6-13-12-4-3-5-14-16(12)11(8-17-14)7-15(13)18(2)9-10/h3-6,8,13,15,17H,7,9H2,1-2H3/t13-,15-/m1/s1
InChIKey XJOOMMHNYOJWCZ-UKRRQHHQSA-N
Literature Reference Author R.POHL,M.DRACINSKY,L.SLAVETINSKA,M.BUDESINSKY
Literature Reference Citation MAGN.RES.CHEM.,49,320(2011)
Literature Reference DOI 10.1002/mrc.2750
Molecular Weight 238.332 g/mol
Solvent CD3OD
Source File Reference UWBT13196