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ERGOLINE-8-METHANOL, 8,9-DIDEHYDRO-6-METHYL-, ACETATE (ESTER)

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ERGOLINE-8-METHANOL, 8,9-DIDEHYDRO-6-METHYL-, ACETATE (ESTER)
SpectraBase Compound ID 1KcTHQ1Kudl
InChI InChI=1S/C18H20N2O2/c1-11(21)22-10-12-6-15-14-4-3-5-16-18(14)13(8-19-16)7-17(15)20(2)9-12/h3-6,8,15,17,19H,7,9-10H2,1-2H3
InChIKey MXXXXLYPPRGOGK-UHFFFAOYSA-N
Mol Weight 296.37 g/mol
Molecular Formula C18H20N2O2
Exact Mass 296.152478 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H2bfgvLYni5
Name Elymoclavine acetate
CAS Registry Number 5080-45-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H20N2O2
InChI InChI=1S/C18H20N2O2/c1-11(21)22-10-12-6-15-14-4-3-5-16-18(14)13(8-19-16)7-17(15)20(2)9-12/h3-6,8,15,17,19H,7,9-10H2,1-2H3
InChIKey MXXXXLYPPRGOGK-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference N.J. Bach, H.E. Boaz, C.J. Chang, E.Wenkert, J. Org. Chem. 39, 1272 (1974).
NMR Standard CDCl3
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3