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1-ALLYL-6-METHYL-8-ALPHA-(DIETHYLCARBAMOYLAMINO)-ERGOLINE
SpectraBase Compound ID HMKlaCA3yUu
InChI InChI=1S/C23H32N4O/c1-5-11-27-14-16-12-21-19(18-9-8-10-20(27)22(16)18)13-17(15-25(21)4)24-23(28)26(6-2)7-3/h5,8-10,14,17,19,21H,1,6-7,11-13,15H2,2-4H3,(H,24,28)/t17-,19+,21+/m0/s1
InChIKey MEBZFVRCLVWKFF-FBBABVLZSA-N
Mol Weight 380.5 g/mol
Molecular Formula C23H32N4O
Exact Mass 380.257612 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4YcosdptMfs
Name 1-ALLYL-6-METHYL-8-ALPHA-(DIETHYLCARBAMOYLAMINO)-ERGOLINE
Compound Number 9A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H32N4O
InChI InChI=1S/C23H32N4O/c1-5-11-27-14-16-12-21-19(18-9-8-10-20(27)22(16)18)13-17(15-25(21)4)24-23(28)26(6-2)7-3/h5,8-10,14,17,19,21H,1,6-7,11-13,15H2,2-4H3,(H,24,28)/t17-,19+,21+/m0/s1
InChIKey MEBZFVRCLVWKFF-FBBABVLZSA-N
Literature Reference Author V.KREN,A.FISEROVA,L.WEIGNEROVA,I.STIBOR,P.HALADA,V.PRIKRYLOV A,P.SEDMERA,M.POSPIS
Literature Reference Citation BIOORG.MED.CHEM.,10,415(2002)
Literature Reference DOI 10.1016/S0968-0896(01)00291-7
Molecular Weight 380.533 g/mol
Solvent CDCl3
Source File Reference UWLU30931