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14-methoxy-6-propylergoline-8beta-carboxylic acid, methyl ester
SpectraBase Compound ID FRTMYGFKkTf
InChI InChI=1S/C20H26N2O3/c1-4-7-22-11-13(20(23)25-3)8-15-14-5-6-17(24-2)19-18(14)12(10-21-19)9-16(15)22/h5-6,10,13,15-16,21H,4,7-9,11H2,1-3H3/t13-,15-,16-/m1/s1
InChIKey DWKAUMWVBIMDAF-FVQBIDKESA-N
Mol Weight 342.44 g/mol
Molecular Formula C20H26N2O3
Exact Mass 342.194343 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FlsLdQwxtvc
Name 14-METHOXY-6-PROPYLERGOLINE-8beta-CARBOXYLIC ACID, METHYL ESTER
Source of Sample W. E. Haefliger, Sandoz Ltd., Basel, Switzerland
Comments Some carbon atoms are unassigned
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H26N2O3
InChI InChI=1S/C20H26N2O3/c1-4-7-22-11-13(20(23)25-3)8-15-14-5-6-17(24-2)19-18(14)12(10-21-19)9-16(15)22/h5-6,10,13,15-16,21H,4,7-9,11H2,1-3H3/t13-,15-,16-/m1/s1
InChIKey DWKAUMWVBIMDAF-FVQBIDKESA-N
Molecular Weight 342.44
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms ERGOLINE-8B-CARBOXYLIC ACID, 14-METHOXY-6-PROPYL-, METHYL ESTER