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OCOBOTRINE
SpectraBase Compound ID IrL0k8CkDwY
InChI InChI=1S/C19H23NO4/c1-20-7-6-19-10-16(24-3)14(21)9-12(19)13(20)8-11-4-5-15(23-2)18(22)17(11)19/h4-5,10,12-13,22H,6-9H2,1-3H3/t12?,13-,19+/m0/s1
InChIKey OWDQPILTDJLGCN-MALMCIGFSA-N
Mol Weight 329.4 g/mol
Molecular Formula C19H23NO4
Exact Mass 329.162708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 12MzYnLTebm
Name Morphinan-7-one, 5,6-didehydro-4-hydroxy-3,6-dimethoxy-17-methyl-, (14.xi.)-
Alternate Name(s) 4-Hydroxy-3,6-dimethoxy-17-methyl-5,6-didehydromorphinan-7-one 14.Xi.-Morphinan-7-one, 5,6-didehydro-4-hydroxy-3,6-dimethoxy-17-methyl- 8,14-Dihydrosalutaridine 4-Hydroxy-3,6-dimethoxy-11-methyl-8,8a,9,10-tetrahydro-7H-9,4b-(epiminoethano)phenanthren-7-one
CAS Registry Number 15444-27-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H23NO4
InChI InChI=1S/C19H23NO4/c1-20-7-6-19-10-16(24-3)14(21)9-12(19)13(20)8-11-4-5-15(23-2)18(22)17(11)19/h4-5,10,12-13,22H,6-9H2,1-3H3/t12?,13-,19+/m0/s1
InChIKey OWDQPILTDJLGCN-MALMCIGFSA-N
Molecular Weight 329.396 g/mol
SMILES Oc1c(ccc2C[C@]3(C4CC(C(=C[C@@]4(CCN3C)c12)OC)=O)[H])OC
SPLASH splash10-03fu-6749000000-d17dc217baf373d53c53
Source of Spectrum AD-0-333-0
Wiley ID 1327141