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(+)-12,14-DICHLORO-3-BETA-ETHOXY-2,3-DIHYDRO-8-BETA-(HYDROXYMETHYL)-6-METHYLERGOLIN-2-ONE
SpectraBase Compound ID EVw1hmVd1Ko
InChI InChI=1S/C18H22Cl2N2O3/c1-3-25-18-6-13-10(4-9(8-23)7-22(13)2)14-11(19)5-12(20)16(15(14)18)21-17(18)24/h5,9-10,13,23H,3-4,6-8H2,1-2H3,(H,21,24)/t9-,10?,13?,18-/m1/s1
InChIKey YRZCZOLBPMRNQD-HTTPZJARSA-N
Mol Weight 385.29 g/mol
Molecular Formula C18H22Cl2N2O3
Exact Mass 384.100748 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ie12fBKeRnZ
Name (+)-12,14-DICHLORO-3-BETA-ETHOXY-2,3-DIHYDRO-8-BETA-(HYDROXYMETHYL)-6-METHYLERGOLIN-2-ONE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H22Cl2N2O3
InChI InChI=1S/C18H22Cl2N2O3/c1-3-25-18-6-13-10(4-9(8-23)7-22(13)2)14-11(19)5-12(20)16(15(14)18)21-17(18)24/h5,9-10,13,23H,3-4,6-8H2,1-2H3,(H,21,24)/t9-,10?,13?,18-/m1/s1
InChIKey YRZCZOLBPMRNQD-HTTPZJARSA-N
Literature Reference Author K.SEIFERT,N.M.PHUONG,B.R.VINCENT
Literature Reference Citation HELV.CHIM.ACTA,75,288(1992)
Literature Reference DOI 10.1002/hlca.19920750125
Molecular Weight 385.290 g/mol
Solvent CD3OD
Source File Reference UWCS6309