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2-Oxomesembrine
SpectraBase Compound ID Gcvcg3mpbtS
InChI InChI=1S/C17H21NO4/c1-18-15-9-12(19)6-7-17(15,10-16(18)20)11-4-5-13(21-2)14(8-11)22-3/h4-5,8,15H,6-7,9-10H2,1-3H3/t15-,17-/m0/s1
InChIKey WEXJXIYUCMEBEX-RDJZCZTQSA-N
Mol Weight 303.36 g/mol
Molecular Formula C17H21NO4
Exact Mass 303.147058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HBxzmnKR3Q9
Name 2-Oxomesembrine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21NO4
InChI InChI=1S/C17H21NO4/c1-18-15-9-12(19)6-7-17(15,10-16(18)20)11-4-5-13(21-2)14(8-11)22-3/h4-5,8,15H,6-7,9-10H2,1-3H3/t15-,17-/m0/s1
InChIKey WEXJXIYUCMEBEX-RDJZCZTQSA-N
Instrument Name Thermo Scientific Focus DSQ
Ionization Type EI
Literature Reference DOI 10.1002/rcm.9116
Molecular Weight 303.358 g/mol
SMILES [C@@]12(CCC(C[C@@]2(N(C(C1)=O)C)[H])=O)c1ccc(c(c1)OC)OC
SPLASH splash10-0fsr-1951000000-48b4b657e445417295a4
Source of Spectrum RCM-35-8-18
Wiley ID 1852116