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Codeinone
SpectraBase Compound ID J8IH2nGKaC8
InChI InChI=1S/C18H19NO3/c1-19-8-7-18-11-4-5-13(20)17(18)22-16-14(21-2)6-3-10(15(16)18)9-12(11)19/h3-6,11-12,17H,7-9H2,1-2H3/t11-,12+,17-,18-/m0/s1
InChIKey XYYVYLMBEZUESM-CMKMFDCUSA-N
Mol Weight 297.35 g/mol
Molecular Formula C18H19NO3
Exact Mass 297.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H2o93Mbop5z
Name Codeinone
CAS Registry Number 467-13-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H19NO3
InChI InChI=1S/C18H19NO3/c1-19-8-7-18-11-4-5-13(20)17(18)22-16-14(21-2)6-3-10(15(16)18)9-12(11)19/h3-6,11-12,17H,7-9H2,1-2H3/t11-,12+,17-,18-/m0/s1
InChIKey XYYVYLMBEZUESM-CMKMFDCUSA-N
Molecular Weight 297.354 g/mol
SMILES [C@@]123c4c5c(OC)ccc4C[C@]([C@@]1(C=CC([C@@]2(O5)[H])=O)[H])(N(CC3)C)[H]
SPLASH splash10-0002-7790000000-52a19a532d9d769d4883
Source of Spectrum CD-205-0-0
Synonyms (5alpha)-7,8-didehydro-4,5-epoxy-3-methoxy-17-methylmorphinan-6-one 6-Codeinone Morphinan-6-one, 7,8-didehydro-4,5-epoxy-3-methoxy-17-methyl-, (5-alpha)- BRN 0094188 EINECS 207-386-1
Wiley ID 1300211