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(3S)-9-Methoxy-20-hydroxy-16,17-dinor-18-seco-yohimbine-15-one
SpectraBase Compound ID 9vxLIyGBwnG
InChI InChI=1S/C18H22N2O3/c1-3-18(22)10-20-8-7-11-16-12(5-4-6-14(16)23-2)19-17(11)13(20)9-15(18)21/h4-6,13,19,22H,3,7-10H2,1-2H3/t13-,18+/m0/s1
InChIKey NPRUSBKVLGYMQO-SCLBCKFNSA-N
Mol Weight 314.38 g/mol
Molecular Formula C18H22N2O3
Exact Mass 314.163043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID nUAKu7do0
Name (3S)-9-Methoxy-20-hydroxy-16,17-dinor-18-seco-yohimbine-15-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22N2O3
InChI InChI=1S/C18H22N2O3/c1-3-18(22)10-20-8-7-11-16-12(5-4-6-14(16)23-2)19-17(11)13(20)9-15(18)21/h4-6,13,19,22H,3,7-10H2,1-2H3/t13-,18+/m0/s1
InChIKey NPRUSBKVLGYMQO-SCLBCKFNSA-N
Molecular Weight 314.385 g/mol
SMILES [nH]1c2cccc(c2c2c1[C@@]1(CC([C@@](CN1CC2)(O)CC)=O)[H])OC
SPLASH splash10-03di-0289000000-47066989b97b787f7072
Source of Spectrum F-56-3149-5
Synonyms (3R,12bS)-3-Ethyl-3-hydroxy-8-methoxy-3,4,6,7,12,12b-hexahydro-1H-indolo[2,3-a]quinolizin-2-one
Wiley ID 856958