For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

1-[(5R,8S,10R)-6-METHYL-8-ERGOLINYL]-3,3-DIETHYLUREA

View entire compound with spectra: 1 NMR

1-[(5R,8S,10R)-6-METHYL-8-ERGOLINYL]-3,3-DIETHYLUREA
SpectraBase Compound ID DAmKh8osQ3z
InChI InChI=1S/C20H28N4O/c1-4-24(5-2)20(25)22-14-10-16-15-7-6-8-17-19(15)13(11-21-17)9-18(16)23(3)12-14/h6-8,11,14,16,18,21H,4-5,9-10,12H2,1-3H3,(H,22,25)/t14-,16+,18+/m1/s1
InChIKey JOAHPSVPXZTVEP-HFTRVMKXSA-N
Mol Weight 340.47 g/mol
Molecular Formula C20H28N4O
Exact Mass 340.226312 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Kk4VRCEHG2J
Name 1-[(5R,8S,10R)-6-METHYL-8-ERGOLINYL]-3,3-DIETHYLUREA
Comments =
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H28N4O
InChI InChI=1S/C20H28N4O/c1-4-24(5-2)20(25)22-14-10-16-15-7-6-8-17-19(15)13(11-21-17)9-18(16)23(3)12-14/h6-8,11,14,16,18,21H,4-5,9-10,12H2,1-3H3,(H,22,25)/t14-,16+,18+/m1/s1
InChIKey JOAHPSVPXZTVEP-HFTRVMKXSA-N
Instrument Name Jeol FX-60
Literature Reference A.CERNY, J.BENES, J.VACHEK, M.PESAK, J.STUCHLIK, M.STUCHLIK, P.SEDMERA,M.FLIEGER, J.VOKOUN (1987) Coll.Czech.Chem.Comm.: v.52, N5, 1331-1339.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d